SCHEMBL18285086

SCHEMBL18285086

C=CC(=O)Nc1ccc(Br)cn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.61
▸ RAB9A P51151 10/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ LMNA P02545 2/20 0.56
▸ F13A1 P00488 1/20 0.56
▸ TGM2 P21980 1/20 0.56
▸ TGM1 P22735 1/20 0.56
▸ TGM3 Q08188 1/20 0.56
▸ NFKB1 P19838 1/20 0.55
▸ NFKB2 Q00653 1/20 0.55
▸ RELA Q04206 1/20 0.55
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ TEK Q02763 2/20 0.51
▸ KDR P35968 1/20 0.51
▸ TP53 P04637 1/20 0.50
▸ MAPK1 P28482 1/20 0.50

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
SCHEMBL17667007 0.80 RAB9A (0.69) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL17667010 0.80 RAB9A (0.69) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5038634 0.79 RAB9A (0.66) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL22455502 0.79 L3MBTL1 (0.66) NPC1RAB9ASMN1; SMN2LMNANFKB1
SCHEMBL1067851 0.78 TSHR (0.65) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL8234749 0.78 RAB9A (0.62) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL20212003 0.78 RAB9A (0.62) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL21808438 0.77 TGM2 (0.44) NPC1LMNAF13A1TGM2TGM1
SCHEMBL30685458 0.77 TGM2 (0.44) NPC1LMNAF13A1TGM2TGM1
SCHEMBL8104147 0.77 RAB9A (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2025-06-17 — — US disclosed
CN-112739695-B Novel thiazole derivative and pharmaceutically acceptable salt thereof 永进药品工业株式会社 2025-03-18 — — CN disclosed
US-12110299-B2 Thiazole derivatives and pharmaceutically acceptable salts thereof YUNGJIN PHARM. CO., LTD. (KR) 2024-10-08 — — US disclosed
EP-3853225-B1 N-(5-(3-(1-((THIAZOL-2-YL)AMINO)-1-OXOPROPAN-2-YL)PHENYL)PYRIDIN-2-YL)ACRYLAMIDE DERIVATIVES AS CDK7 INHIBITORS FOR THE TREATMENT OF CANCER YUNGJIN PHARMACEUTICAL CO LTD (KR) 2023-11-29 — — EP disclosed
EP-3853225-B1 N-(5-(3-(1-((THIAZOL-2-YL)AMINO)-1-OXOPROPAN-2-YL)PHENYL)PYRIDIN-2-YL)ACRYLAMIDE DERIVATIVES AS CDK7 INHIBITORS FOR THE TREATMENT OF CANCER YUNGJIN PHARMACEUTICAL CO LTD (KR) 2023-11-29 — — EP disclosed
EP-3302448-B1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE ONCOLOGY LTD (IN) 2023-10-25 — — EP disclosed
EP-3302448-B1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE ONCOLOGY LTD (IN) 2023-10-25 — — EP disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 — — US disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 — — US disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 — — US disclosed
US-10689347-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2020-06-23 — — US disclosed
WO-2020060112-A1 NOVEL THIAZOLE DERIVATIVES AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF YUNGJIN PHARM. CO., LTD. (KR) 2020-03-26 — — WO disclosed
US-20190091226-A1 NITROGENOUS HETEROCYCLIC COMPOUND, PREPARATION METHOD, INTERMEDIATE, COMPOSITION AND USE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2019-03-28 — — US disclosed
EP-3424928-A1 NITROGENOUS HETEROCYCLIC COMPOUND, PREPARATION METHOD, INTERMEDIATE, COMPOSITION AND USE Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2019-01-09 — — EP disclosed
US-20180362471-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-12-20 — — US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 — — US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 — — US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 — — US disclosed
EP-3302448-A1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS Aurigene Discovery Technologies Limited (IN) 2018-04-11 — — EP disclosed
WO-2016193939-A1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-12-08 — — 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-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 NPC1 3851/4885RAB9A 1346/4885SMN1; SMN2 1062/4885
US-20180362471-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK17, CDK1 NPC1 3824/4885RAB9A 1572/4885SMN1; SMN2 1068/4885
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK17, CDK1 NPC1 3824/4885RAB9A 1572/4885SMN1; SMN2 1068/4885
US-10689347-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 NPC1 3851/4885RAB9A 1346/4885SMN1; SMN2 1062/4885
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 NPC1 3851/4885RAB9A 1346/4885SMN1; SMN2 1062/4885
US-12110299-B2 Thiazole derivatives and pharmaceutically acceptable salts thereof CDKL1, CDK4, CDKL3 NPC1 2287/4885RAB9A 2512/4885SMN1; SMN2 2191/4885
US-20190091226-A1 NITROGENOUS HETEROCYCLIC COMPOUND, PREPARATION METHOD, INTERMEDIATE, COMPOSITION AND USE ERBB2, EGFR, ERBB4 NPC1 2217/4885RAB9A 1468/4885SMN1; SMN2 3422/4885

“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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