SCHEMBL17186264

SCHEMBL17186264

Nc1nc2nc[nH]c2c(=O)n1CCc1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 2/20 0.44
▸ DBF4 Q9UBU7 2/20 0.44
▸ PNP P00491 1/20 0.44
▸ ADORA3 P0DMS8 4/20 0.42
▸ ADORA2B P29275 4/20 0.42
▸ TNF P01375 1/20 0.41
▸ NOD2 Q9HC29 1/20 0.41
▸ NOD1 Q9Y239 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ ACP1 P24666 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ DAO P14920 1/20 0.38
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37

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 SCHEMBL18605687 0.99 CDC7 (0.43) CDC7DBF4PNPADORA3ADORA2B
SCHEMBL17186410 0.88 TNF (0.49) CDC7DBF4PNPADORA3ADORA2B
Hydrochloric Acid SCHEMBL17186309 0.87 TNF (0.48) CDC7DBF4PNPADORA3ADORA2B
SCHEMBL17186279 0.86 KMT2A (0.48) PNPADORA3ADORA2BKMT2ADAO
SCHEMBL17186303 0.86 ADORA2B (0.45) PNPADORA3ADORA2BKMT2ADAO
Hydrochloric Acid SCHEMBL18605858 0.85 KMT2A (0.47) PNPADORA3ADORA2BKMT2ADAO
Hydrochloric Acid SCHEMBL18605668 0.85 ADORA2B (0.44) PNPADORA3ADORA2BKMT2ADAO
SCHEMBL6268535 0.83 ADORA3 (0.60) PNPADORA3ADORA2BLMNAKMT2A
Hydrochloric Acid SCHEMBL17186430 0.82 ADORA3 (0.59) PNPADORA3ADORA2BLMNAKMT2A
SCHEMBL17186484 0.81 ADORA3 (0.53) PNPADORA3ADORA2BLMNAKMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 — — US claimed
EP-3131877-A1 GUANIDINE COMPOUNDS AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-02-22 — — EP claimed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 — — WO claimed
EP-3131877-B1 BIGUANIDE COMPOUNDS IMMUNOMET THERAPEUTICS INC (US) 2023-07-19 — — EP disclosed
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 — — US disclosed
EP-3131877-A1 GUANIDINE COMPOUNDS AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-02-22 — — EP disclosed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 — — WO 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 (1 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-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF PC, TFAM, PCK2 CDC7 2736/4885DBF4 3355/4885PNP 292/4885

“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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