SCHEMBL2302128

SCHEMBL2302128

CCOC(=O)C=Cc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HSP90AA1 P07900 1/20 0.49
TTR P02766 1/20 0.48
DPP4 P27487 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ATM Q13315 1/20 0.47
LMNA P02545 2/20 0.47
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
TUBB4A P04350 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
SCHEMBL29550384 1.00 CA12 (0.51) CA12CA1CA2CA7CA9
SCHEMBL2302901 1.00 CA12 (0.51) CA12CA1CA2CA7CA9
SCHEMBL22881952 0.88 APP (0.50) KEAP1NFE2L2NPC1RAB9AHSP90AA1
SCHEMBL3668367 0.85 LMNA (0.48) KEAP1NFE2L2NPC1RAB9AMEN1
SCHEMBL6798384 0.85 ATM (0.53) KEAP1NFE2L2HSP90AA1ATM
SCHEMBL6798388 0.85 ATM (0.53) KEAP1NFE2L2HSP90AA1ATM
SCHEMBL28730465 0.83 HSP90AA1 (0.46) KEAP1NFE2L2NPC1RAB9AHSP90AA1
SCHEMBL27224520 0.83 APP (0.54) ATMLMNACYP3A4SMN1; SMN2ALDH1A1
SCHEMBL643378 0.81 HSP90AA1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL643379 0.81 HSP90AA1 (0.53) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114196309-B Weather-resistant self-repairing coating and preparation method thereof 广东美涂士建材股份有限公司 2022-07-12 CN claimed
CN-114196309-A Weather-resistant self-repairing coating and preparation method thereof 广东美涂士建材股份有限公司 2022-03-18 CN claimed
CN-111138350-B Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2021-08-10 CN claimed
CN-111138350-A Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2020-05-12 CN claimed
CN-119604488-A Protein tyrosine kinase inhibitor and medical application thereof 苏州必扬医药科技有限公司 2025-03-11 CN disclosed
CN-114196309-B Weather-resistant self-repairing coating and preparation method thereof 广东美涂士建材股份有限公司 2022-07-12 CN disclosed
CN-114196309-A Weather-resistant self-repairing coating and preparation method thereof 广东美涂士建材股份有限公司 2022-03-18 CN disclosed
CN-111138350-B Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2021-08-10 CN disclosed
CN-111138350-B Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2021-08-10 CN disclosed
CN-111138350-A Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2020-05-12 CN disclosed
CN-111138350-A Asymmetric synthesis method of dexchlorpheniramine and dexbrompheniramine 中国药科大学 2020-05-12 CN disclosed
EP-3004118-B1 USE OF CONDENSED BENZO[B]THIAZINE DERIVATIVES AS CYTOPROTECTANTS ARANDA PHARMA LTD (FI) 2018-12-19 EP disclosed
EP-1124822-A1 THROMBIN INHIBITORS Merck & Co., Inc. (US) 2001-08-22 EP disclosed
EP-0694546-B1 Substituted dibenzoxazepine compounds, pharmaceutical compositions and use SEARLE & CO (US) 2001-06-06 EP disclosed
WO-2000026211-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2000-05-11 WO disclosed
EP-0839798-A2 Intermediates for preparating non-peptide retroviral protease inhibitors ABBOTT LABORATORIES (US) 1998-05-06 EP disclosed
US-5670675-A Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1997-09-23 US disclosed
US-5545750-A TREATING HUMAN IMMUNODEFICIENCY VIRUS ABBOTT LABORATORIES (US) 1996-08-13 US disclosed
US-5142056-A Human immunodeficiency virus protease inhibitor ABBOTT LABORATORIES (US) 1992-08-25 US disclosed
EP-0402646-A1 Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1990-12-19 EP disclosed