SCHEMBL5722720

SCHEMBL5722720

BrC1Cc2ccccc2O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.42
MAOA P21397 6/20 0.42
AOC2 O75106 5/20 0.42
CHRM2 P08172 2/20 0.42
CHRM4 P08173 2/20 0.42
CHRM5 P08912 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
DAO P14920 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
NISCH Q9Y2I1 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
AR P10275 1/20 0.37
CYP19A1 P11511 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36

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
SCHEMBL29935960 1.00 MAOB (0.42) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL10698516 0.80 MAOB (0.39) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL2713231 0.80 MAOA (0.43) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL5572317 0.77 MAOA (0.38) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL31015921 0.77 CHRM2 (0.40) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL14837286 0.77 TSHR (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL22474472 0.76 CHRM2 (0.42) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL11215570 0.76 HSP90AB1 (0.44) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL5779685 0.74 MAOB (0.41) MAOBMAOAAOC2CHRM2CHRM4
SCHEMBL3663270 0.74 MAOA (0.45) MAOBMAOAAOC2CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638106-A Novel method for synthesizing hexamethylation sophoraflavanone J 西南交通大学 2024-09-13 CN disclosed
CN-118234730-A Heterocyclic NLRP3 inhibitors 豪夫迈·罗氏有限公司 2024-06-21 CN disclosed
CN-110452201-A A kind of synthetic method of benzofurans heterocyclic sulfonyl chloride TAIZHOU POLYTECHNIC COLLEGE 2019-11-15 CN disclosed
CN-107216336-A Camptothecine compounds and its preparation and use 李雨亮 2017-09-29 CN disclosed
CN-106986865-A On Mental disease or the compound and medical composition of malignant tumour 国立大学法人京都大学 2017-07-28 CN disclosed
CN-106660982-A Histone demethylase inhibitors 赛尔基因昆蒂赛尔研究公司 2017-05-10 CN disclosed
CN-104045625-A INDOLE AND INDAZOLE COMPOUNDS THAT ACTIVATE AMPK PFIZER 2014-09-17 CN disclosed
CN-103509030-A Camptothecin compound and preparation and application thereof LI YULIANG 2014-01-15 CN disclosed
EP-0841925-B1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2006-10-04 EP disclosed
US-6482956-B2 FOR THERAPY OF CARDIOVASCULAR, CEREBROVASCULAR, RESPIRATORY AND RENAL DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-11-19 US disclosed
EP-1036062-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS Pfizer Limited (GB) 2000-09-20 EP disclosed
US-6096897-A NOVEL 1,2,3-TRIAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2000-08-01 US disclosed
US-5969151-A PYRAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1999-10-19 US disclosed
US-5958968-A CARDIOVASCULAR DISORDERS; KIDNEY DIEASES SMITHKLINE BEECHAM CORPORATION (US) 1999-09-28 US disclosed
WO-1999029667-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LIMITED (GB) 1999-06-17 WO disclosed
CN-1196680-A Endothelin receptor antagonists SMITHKLINE BEECHAM CORP (US) 1998-10-21 CN disclosed
EP-0841925-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-05-20 EP disclosed
WO-1997004772-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-02-13 WO disclosed
CN-1007248-B PROCESS FOR MANUFACTURING OF FLOOD SUGAR REDUCING MEDICINE-THIAZOLIDINEDIONS PFIZER (US) 1990-03-21 CN disclosed
CN-86104075-A Preparation method of hypoglycemic agent-thiazolidinedione 1987-03-11 CN disclosed