SCHEMBL524524

SCHEMBL524524

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1ccc(Cc2ccncc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 1.00
MAPK11 Q15759 2/20 1.00
ERBB2 P04626 1/20 1.00
MAPK13 O15264 2/20 0.72
RAF1 P04049 1/20 0.72
MAPT P10636 1/20 0.67
MAPK12 P53778 1/20 0.67

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
SCHEMBL9923555 0.91 MAPK14 (0.84) MAPK14MAPK11ERBB2MAPK13MAPT
SCHEMBL669330 0.89 MAPK14 (1.00) MAPK14MAPK11ERBB2MAPK13MAPT
SCHEMBL667670 0.88 MAPK14 (1.00) MAPK14MAPK11ERBB2MAPK13MAPT
SCHEMBL5732952 0.88 MAPK14 (0.78) MAPK14MAPK11ERBB2MAPK13MAPK12
SCHEMBL5571957 0.86 MAPK14 (1.00) MAPK14MAPK11ERBB2MAPK13RAF1
SCHEMBL668120 0.86 MAPK14 (1.00) MAPK14MAPK11ERBB2MAPK13RAF1
SCHEMBL939485 0.86 MAPK14 (1.00) MAPK14MAPK11ERBB2MAPK13RAF1
SCHEMBL2959754 0.85 MAPK14 (0.76) MAPK14MAPK11ERBB2MAPK13MAPT
SCHEMBL4594410 0.85 MAPK14 (0.82) MAPK14MAPK11ERBB2MAPK13MAPK12
SCHEMBL938855 0.84 MAPK14 (0.75) MAPK14MAPK11ERBB2MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160128974-A1 ANTI-CXCR4 AS A SENSITIZER TO CANCER THERAPEUTICS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-05-12 US claimed
US-9155723-B2 Anti-CXCR4 as a sensitizer to cancer therapeutics THE GENERAL HOSPITAL CORPORATION (US) 2015-10-13 US claimed
US-20130216531-A1 ANTI-CXCR4 AS A SENSITIZER TO CANCER THERAPEUTICS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-08-22 US claimed
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP claimed
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US claimed
US-20030049660-A1 P38 MAPK pathway predicts endocrine-resistant growth of human breast cancer and provides a novel diagnostic and treatment target BAYLOR COLLEGE OF MEDICINE 2003-03-13 US claimed
US-20250002844-A1 GENERATION AND MAINTENANCE OF STEM CELLS THE SCRIPPS RESEARCH INSTITUTE 2025-01-02 US disclosed
US-12054741-B2 Generation and maintenance of stem cells THE SCRIPPS RESEARCH INSTITUTE (US) 2024-08-06 US disclosed
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof RACE ONCOLOGY LTD. (AU) 2021-10-19 US disclosed
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof RACE ONCOLOGY LTD. (AU) 2021-10-05 US disclosed
CN-112472699-A Combination methods for improving the therapeutic benefit of bisantrene and derivatives 种族肿瘤学公司 2021-03-12 CN disclosed
US-20200163939-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF SG CREDIT PARTNERS, INC. 2020-05-28 US disclosed
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF RACE ONCOLOGY LTD. (AU) 2020-05-28 US disclosed
EP-1047418-B1 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS BAYER PHARMACEUTICALS CORP (US) 2005-07-27 EP disclosed
CN-1544420-A Inhibition of raf kinase using substituted heterocyclic ureas 2004-11-10 CN disclosed
US-20030049660-A1 P38 MAPK pathway predicts endocrine-resistant growth of human breast cancer and provides a novel diagnostic and treatment target BAYLOR COLLEGE OF MEDICINE 2003-03-13 US disclosed
WO-2003000189-A2 PREDICTION, DIAGNOSIS AND TREATMENT OF ENDOCRINE RESISTANT BREAST CANCER, USING P38 MAPK PATHWAY BAYLOR COLLEGE OF MEDICINE (US) 2003-01-03 WO disclosed
EP-1047418-A4 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS BAYER AG (US) 2001-02-07 EP disclosed
EP-1047418-A1 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS Bayer Corporation (US) 2000-11-02 EP disclosed
WO-1999032106-A1 INHIBITION OF RAF KINASE USING SUBSTITUTED HETEROCYCLIC UREAS BAYER CORPORATION (US) 1999-07-01 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 (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-20200163939-A1 COMBINATORIAL METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, CYP11B1, MCL1 MAPK14 4493/4885MAPK11 3954/4885ERBB2 1593/4885
US-11135201-B2 Compositions to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, HCCS, MCL1 MAPK14 4689/4885MAPK11 4323/4885ERBB2 2165/4885
US-11147800-B2 Combinatorial methods to improve the therapeutic benefit of bisantrene and analogs and derivatives thereof CYP3A43, CYP11B1, MCL1 MAPK14 4493/4885MAPK11 3954/4885ERBB2 1593/4885
US-20200163940-A1 COMPOSITIONS TO IMPROVE THE THERAPEUTIC BENEFIT OF BISANTRENE AND ANALOGS AND DERIVATIVES THEREOF CYP3A43, HCCS, MCL1 MAPK14 4689/4885MAPK11 4323/4885ERBB2 2165/4885

“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.