SCHEMBL1420453

SCHEMBL1420453

O=C(Nc1cc(Cl)cc2c1[nH]c1cnccc12)c1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHUK O15111 13/20 1.00
▸ ICOSLG O75144 10/20 1.00
▸ ICOS Q9Y6W8 10/20 1.00
▸ IKBKB O14920 2/20 1.00
▸ MEN1 O00255 1/20 1.00
▸ PIM1 P11309 1/20 1.00
▸ KMT2A Q03164 1/20 1.00
▸ PIM3 Q86V86 1/20 1.00
▸ IKBKG Q9Y6K9 1/20 1.00
▸ KCNMA1 Q12791 1/20 0.56

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
SCHEMBL29359984 1.00 CHUK (1.00) CHUKICOSLGICOSIKBKBMEN1
Hydrochloric Acid SCHEMBL12471533 0.99 CHUK (0.98) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL14253037 0.92 CHUK (1.00) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL13377038 0.90 CHUK (1.00) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL13376959 0.89 CHUK (0.89) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL8378079 0.88 CHUK (0.78) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL2768947 0.87 CHUK (0.78) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL14253078 0.86 CHUK (0.83) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL14253005 0.86 CHUK (0.83) CHUKICOSLGICOSIKBKBMEN1
SCHEMBL14253081 0.85 CHUK (0.75) CHUKICOSLGICOSIKBKBMEN1

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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10744141-B2 Compositions and methods for treating cancer CASE WESTERN RESERVE UNIVERSITY (US) 2020-08-18 — — US claimed
US-20180185382-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER CASE WESTERN RESERVE UNIVERSITY 2018-07-05 — — US claimed
EP-3313819-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER Case Western Reserve University (US) 2018-05-02 — — EP claimed
WO-2016210134-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER CASE WESTERN RESERVE UNIVERSITY (US) 2016-12-29 — — WO claimed
US-9248124-B2 Use of inhibitors of IκB kinase for the treatment of cancer MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-02-02 — — US claimed
WO-2013052844-A1 METHODS FOR TREATING AND DIAGNOSING RESPIRATORY TRACT INFECTIONS PULMATRIX, INC. (US) 2013-04-11 — — WO claimed
EP-1443927-B1 CARBOLINE DERIVATIVES AS INHIBITORS OF IKB IN THE TREATMENT OF MULTIPLE MYELOMA MILLENNIUM PHARM INC (US) 2007-01-10 — — EP claimed
US-20050049265-A1 Including multiple myeloma; I kappa B [i$g(k)b] kinase MILLENNIUM PHARMACEUTICALS, INC (US) 2005-03-03 — — US claimed
EP-1443927-A2 CARBOLINE DERIVATIVES AS INHIBITORS OF IKB IN THE TREATMENT OF MULTIPLE MYELOMA AND OTHER CANCERS Millennium Pharmaceuticals, Inc. (US) 2004-08-11 — — EP claimed
WO-2003039545-A2 CARBOLINE DERIVATIVES AS INHIBITORS OF IKB IN THE TREATMENT OF MULTIPLE MYELOMA AND OTHERS CANCERS MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-05-15 — — WO claimed
WO-2024189607-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR DISEASES TREATMENT DIDENKO KIRILL (MX) 2024-09-19 — — WO disclosed
WO-2023118005-A1 COMPOSITION CONTAINING THE COMBINATION OF A C-GLYCOSIDE AND ESCIN FOR THE CARE OF THE EYE AREA L'OREAL (FR) 2023-06-29 — — WO disclosed
US-20220040096-A1 AURIS FORMULATIONS FOR TREATING OTIC DISEASES AND CONDITIONS OTONOMY INC (US) 2022-02-10 — — US disclosed
US-11123286-B2 Auris formulations for treating otic diseases and conditions OTONOMY, INC. (US) 2021-09-21 — — US disclosed
US-11123285-B2 Auris formulations for treating OTIC diseases and conditions OTONOMY, INC. (US) 2021-09-21 — — US disclosed
WO-2003039545-A2 CARBOLINE DERIVATIVES AS INHIBITORS OF IKB IN THE TREATMENT OF MULTIPLE MYELOMA AND OTHERS CANCERS MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-05-15 — — WO disclosed
EP-1268477-A1 SUBSTITUTED BETA-CARBOLINES WITH IKB-KINASE INHIBITING ACTIVITY Aventis Pharma Deutschland GmbH (DE) 2003-01-02 — — EP disclosed
US-20020099068-A1 Substituted beta carbolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-07-25 — — US disclosed
EP-1209158-A1 Substituted beta-carbolines Aventis Pharma Deutschland GmbH (DE) 2002-05-29 — — EP disclosed
WO-2001068648-A1 SUBSTITUTED BETA-CARBOLINES WITH IKB-KINASE INHIBITING ACTIVITY AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-09-20 — — 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 (7 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-20050049265-A1 Including multiple myeloma; I kappa B [i$g(k)b] kinase IKBKE, IKBKB, IKBKG CHUK 5/4885ICOSLG 2722/4885ICOS 2443/4885
US-20220040096-A1 AURIS FORMULATIONS FOR TREATING OTIC DISEASES AND CONDITIONS OTC, AQP4, SLC26A4 CHUK 1087/4885ICOSLG 123/4885ICOS 133/4885
US-20180185382-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER PPP2CA, PPP3CA, PPP4C CHUK 848/4885ICOSLG 4701/4885ICOS 4250/4885
US-11123286-B2 Auris formulations for treating otic diseases and conditions OTC, AQP4, SLC26A4 CHUK 1087/4885ICOSLG 123/4885ICOS 133/4885
US-10744141-B2 Compositions and methods for treating cancer PPP2CA, PPP3CA, PPP4C CHUK 848/4885ICOSLG 4701/4885ICOS 4250/4885
US-11123285-B2 Auris formulations for treating OTIC diseases and conditions OTC, AQP4, SLC26A4 CHUK 1087/4885ICOSLG 123/4885ICOS 133/4885
US-20020099068-A1 Substituted beta carbolines CSNK1A1, CSNK2A1, CSNK2B CHUK 52/4885ICOSLG 4842/4885ICOS 4455/4885

“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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