SCHEMBL1055201

SCHEMBL1055201

Nn1c(=O)ccc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.57
CA9 Q16790 2/20 0.57
BRD4 O60885 1/20 0.57
BRPF1 P55201 1/20 0.57
KAT2B Q92831 1/20 0.57
BRD9 Q9H8M2 1/20 0.57
ALDH1A1 P00352 2/20 0.38
NOS2 P35228 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 3/20 0.37
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37
PRKCA P17252 1/20 0.37
PRKACA P17612 1/20 0.37
PRKACG P22612 1/20 0.37
PRKACB P22694 1/20 0.37
PRKCH P24723 1/20 0.37
PRKCI P41743 1/20 0.37
PRKCE Q02156 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
SCHEMBL1052080 0.74 CA12 (0.59) CA12CA9BRD4BRPF1KAT2B
SCHEMBL9807889 0.74 CA12 (0.39) CA12CA9BRD4BRPF1KAT2B
SCHEMBL31037170 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL18938478 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL29967380 0.73 BRPF1 (1.00) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1054493 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL1055461 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL271495 0.73 CA12 (0.63) CA12CA9BRD4BRPF1KAT2B
SCHEMBL487525 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B
SCHEMBL29313185 0.73 CA12 (0.57) CA12CA9BRD4BRPF1KAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2072509-A1 1-Aryl-1H-quinoline-2-ones: process for their production and their use as anti-inflammatory agents Bayer Schering Pharma Aktiengesellschaft (DE) 2009-06-24 EP claimed
JP-54151985-A None JP disclosed
US-20170368060-A1 Piperazine-Substituted Benzothiophenes For Treatment of Mental Disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-12-28 US disclosed
US-9783512-B2 Bicyclic methylene aziridines and reactions thereof WISCONSIN ALUMI RESEARCH FOUNDATION (US) 2017-10-10 US disclosed
US-9783512-B2 Bicyclic methylene aziridines and reactions thereof WISCONSIN ALUMI RESEARCH FOUNDATION (US) 2017-10-10 US disclosed
US-20160075668-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2016-03-17 US disclosed
US-9221842-B2 Bicyclic methylene aziridines and reactions thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2015-12-29 US disclosed
US-9221842-B2 Bicyclic methylene aziridines and reactions thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2015-12-29 US disclosed
US-9115151-B2 Substituted 2,10-dihydro-9-oxa-1,2,4A-triazaphenanthren-3-ones and uses thereof ABBVIE INC. (US) 2015-08-25 US disclosed
US-20140206663-A1 TRIAZINONE COMPOUNDS WUXI APPTECH (SHANGHAI) CO., LTD. (CN) 2014-07-24 US disclosed
EP-0467325-A2 Carbostyril derivatives SYNTEX (U.S.A.) INC. (US) 1992-01-22 EP disclosed
EP-0467325-A2 Carbostyril derivatives SYNTEX (U.S.A.) INC. (US) 1992-01-22 EP disclosed
US-5082847-A Antiarrhythmia SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed
US-5082847-A Antiarrhythmia SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed
EP-0311634-A4 6-(6-ALKYLPYRIDONE)-CARBOSTYRIL COMPOUNDS AND THEIR CARDIOTONIC USES. RORER INTERNAT OVERSEAS INC (US) 1989-06-26 EP disclosed
EP-0311634-A1 6-(6-ALKYLPYRIDONE)-CARBOSTYRIL COMPOUNDS AND THEIR CARDIOTONIC USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-04-19 EP disclosed
US-4785005-A 6-(6-alkylpyridone)-carbostyril compounds and their cardiotonic uses RORER PHARMACEUTICAL CORPORATION (US) 1988-11-15 US disclosed
WO-1988000188-A1 6-(6-ALKYLPYRIDONE)-CARBOSTYRIL COMPOUNDS AND THEIR CARDIOTONIC USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-01-14 WO disclosed
US-4298739-A ANTICOAGULANTS, ANTIINFLAMMATORY, ANTIULCER, VASODILATOR, PHOSPHODIESTERASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1981-11-03 US disclosed
JP-S54151985-A PREPARATION OF AMINOCARBOSTYRIL DERIVATIVE OTSUKA PHARMACEUT CO LTD 1979-11-29 JP 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 (3 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-20170368060-A1 Piperazine-Substituted Benzothiophenes For Treatment of Mental Disorders GRIN2C, TPH1, HTR2C CA12 4505/4885CA9 4837/4885BRD4 47/4885
US-20140206663-A1 TRIAZINONE COMPOUNDS THPO, IL5, CYP11B2 CA12 3540/4885CA9 2939/4885BRD4 1157/4885
US-20160075668-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF AAAS, CYCS, AOC2 CA12 3317/4885CA9 965/4885BRD4 312/4885

“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.