SCHEMBL13584759

SCHEMBL13584759

CN(C)C(=N)NC(=N)NCc1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.53
▸ PKM P14618 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ RECQL P46063 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CTSL P07711 1/20 0.49
▸ USP2 O75604 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KEAP1 Q14145 1/20 0.47
▸ FES P07332 1/20 0.46
▸ RET P07949 1/20 0.46
▸ MARK3 P27448 1/20 0.46
▸ TYK2 P29597 1/20 0.46
▸ FLT4 P35916 1/20 0.46
▸ SYK P43405 1/20 0.46
▸ CLK2 P49760 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL13584132 0.99 ALDH1A1 (0.51) ALDH1A1PKMKMT2ARECQLHTT
SCHEMBL19493948 0.83 KMT2A (0.47) ALDH1A1PKMKMT2ARECQLHTT
SCHEMBL30165326 0.82 KEAP1 (0.59) ALDH1A1RECQLHTTSMN1; SMN2CTSL
SCHEMBL13584673 0.82 KEAP1 (0.59) ALDH1A1RECQLHTTSMN1; SMN2CTSL
SCHEMBL13584425 0.82 KMT2A (0.46) ALDH1A1KMT2ASMN1; SMN2GAACYP2D6
Hydrochloric Acid SCHEMBL13583573 0.81 KEAP1 (0.57) ALDH1A1RECQLHTTSMN1; SMN2CTSL
SCHEMBL29055220 0.81 RECQL (0.62) ALDH1A1PKMKMT2ARECQLHTT
Hydrochloric Acid SCHEMBL13584530 0.80 KMT2A (0.45) ALDH1A1KMT2ASMN1; SMN2GAACYP2D6
SCHEMBL14289021 0.80 ALDH1A1 (0.60) ALDH1A1PKMKMT2ARECQLHTT
SCHEMBL17777457 0.79 ALDH1A1 (0.51) ALDH1A1PKMKMT2ARECQLHTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180256520-A1 BIGUANIDE DERIVATIVE, A PREPARATION METHOD THEREOF, AND A PHARMACEUTICAL COMPOSITION CONTAINING THE BIGUANIDE DERIVATIVE AS AN ACTIVE INGREDIENT HANALL BIOPHARMA CO., LTD. (KR) 2018-09-13 — — US claimed
US-9993446-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2018-06-12 — — US claimed
US-20160317478-A1 Biguanide Derivative, A Preparation Method Thereof, And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient IMMUNOMET THERAPEUTICS INC. 2016-11-03 — — US claimed
US-9416098-B2 Biguanide derivative, a preparation method thereof and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2016-08-16 — — US claimed
EP-2522653-A2 BIGUANIDE DERIVATIVE, A PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION CONTAINING THE BIGUANIDE DERIVATIVE AS AN ACTIVE INGREDIENT HanAll Biopharma Co., Ltd. (KR) 2012-11-14 — — EP claimed
US-20120283299-A1 Biguanide Derivative, A Preparation Method Thereof And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient HANALL BIOPHARMA CO., LTD. (KR) 2012-11-08 — — US claimed
US-10376480-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2019-08-13 — — US disclosed
US-10376480-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2019-08-13 — — US disclosed
US-20180256520-A1 BIGUANIDE DERIVATIVE, A PREPARATION METHOD THEREOF, AND A PHARMACEUTICAL COMPOSITION CONTAINING THE BIGUANIDE DERIVATIVE AS AN ACTIVE INGREDIENT HANALL BIOPHARMA CO., LTD. (KR) 2018-09-13 — — US disclosed
US-9993446-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2018-06-12 — — US disclosed
US-9993446-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2018-06-12 — — US disclosed
US-20160317478-A1 Biguanide Derivative, A Preparation Method Thereof, And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient IMMUNOMET THERAPEUTICS INC. 2016-11-03 — — US disclosed
US-20160317478-A1 Biguanide Derivative, A Preparation Method Thereof, And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient IMMUNOMET THERAPEUTICS INC. 2016-11-03 — — US disclosed
US-9416098-B2 Biguanide derivative, a preparation method thereof and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2016-08-16 — — US disclosed
US-9416098-B2 Biguanide derivative, a preparation method thereof and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2016-08-16 — — US disclosed
US-9416098-B2 Biguanide derivative, a preparation method thereof and a pharmaceutical composition containing the biguanide derivative as an active ingredient IMMUNOMET THERAPEUTICS INC. (US) 2016-08-16 — — US disclosed
EP-2522653-A2 BIGUANIDE DERIVATIVE, A PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION CONTAINING THE BIGUANIDE DERIVATIVE AS AN ACTIVE INGREDIENT HanAll Biopharma Co., Ltd. (KR) 2012-11-14 — — EP disclosed
US-20120283299-A1 Biguanide Derivative, A Preparation Method Thereof And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient HANALL BIOPHARMA CO., LTD. (KR) 2012-11-08 — — US disclosed
US-20120283299-A1 Biguanide Derivative, A Preparation Method Thereof And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient HANALL BIOPHARMA CO., LTD. (KR) 2012-11-08 — — US disclosed
US-20120283299-A1 Biguanide Derivative, A Preparation Method Thereof And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient HANALL BIOPHARMA CO., LTD. (KR) 2012-11-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180256520-A1 BIGUANIDE DERIVATIVE, A PREPARATION METHOD THEREOF, AND A PHARMACEUTICAL COMPOSITION CONTAINING THE BIGUANIDE DERIVATIVE AS AN ACTIVE INGREDIENT PRKAG1, PRKAG3, PRKAG2 ALDH1A1 3161/4885PKM 815/4885KMT2A 2501/4885
US-20120283299-A1 Biguanide Derivative, A Preparation Method Thereof And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient PRKAG1, PRKAG2, PRKAG3 ALDH1A1 3071/4885PKM 883/4885KMT2A 2514/4885
US-20160317478-A1 Biguanide Derivative, A Preparation Method Thereof, And A Pharmaceutical Composition Containing The Biguanide Derivative As An Active Ingredient PRKAG1, PRKAG3, PRKAG2 ALDH1A1 3441/4885PKM 818/4885KMT2A 2430/4885
US-10376480-B2 Biguanide derivative, a preparation method thereof, and a pharmaceutical composition containing the biguanide derivative as an active ingredient PRKAG1, PRKAG3, PRKAG2 ALDH1A1 3161/4885PKM 815/4885KMT2A 2501/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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