SCHEMBL294216

SCHEMBL294216

CCCCC=Cc1cc[c]cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.40
KCNH2 Q12809 2/20 0.36
PDE5A O76074 1/20 0.36
SIGMAR1 Q99720 2/20 0.33
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
TSHR P16473 2/20 0.32
CYP2C19 P33261 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2D6 P10635 1/20 0.31
AHR P35869 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
OXER1 Q8TDS5 1/20 0.30

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
SCHEMBL294215 1.00 TNNC1 (0.40) TNNC1KCNH2PDE5ASIGMAR1CYP1A2
SCHEMBL677437 0.94 TNNC1 (0.46) TNNC1KCNH2TRPV1
SCHEMBL677438 0.94 TNNC1 (0.46) TNNC1KCNH2TRPV1
SCHEMBL5207717 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL3846447 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL5202029 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL5204059 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL8137422 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL5207616 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1
SCHEMBL9051758 0.92 TNNC1 (0.48) TNNC1KCNH2TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023137133-A2 PROCESS FOR THE SELECTIVE CATALYTIC HYDROGENATION OF DIENONES BASF SE (DE) 2023-07-20 WO disclosed
US-20230012337-A1 POLYESTERS CLARIANT INTERNATIONAL LTD. (CH) 2023-01-12 US disclosed
WO-2021116049-A1 POLYESTERS CLARIANT INTERNATIONAL LTD (CH) 2021-06-17 WO disclosed
WO-2021118814-A1 A DETERGENT COMPOSITION COMPRISING A POLYMER THE PROCTER & GAMBLE COMPANY (US) 2021-06-17 WO disclosed
EP-3835396-A1 A DETERGENT COMPOSITION COMPRISING A POLYMER The Procter & Gamble Company (US) 2021-06-16 EP disclosed
US-20210171874-A1 DETERGENT COMPOSITION COMPRISING A POLYMER THE PROCTER AND GAMBLE COMPANY 2021-06-10 US disclosed
CN-107669669-A novel glucagon receptor antagonist 症变治疗公司 2018-02-09 CN disclosed
CN-107250091-A Method for synthesizing optically active carbonyl compound 巴斯夫欧洲公司 2017-10-13 CN disclosed
CN-101610995-B Glucagon receptor antagonists 症变治疗公司 2017-08-08 CN disclosed
US-9260593-B2 Conjugated diene rubber modified with polar alkoxysilane, method and composition thereof TSRC CORPORATION (TW) 2016-02-16 US disclosed
CN-100350968-C Modification of feeding behavior IMP COLLEGE INNOVATIONS LTD (GB) 2007-11-28 CN disclosed
US-20070208128-A1 POLYCARBONATE RESIN COMPOSITION WITH IMPROVED LIGHT REFLECTANCE AND FLAME RETARDANCY CHEIL INDUSTRIES INC. (KR) 2007-09-06 US disclosed
EP-0980867-B1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES (JP) 2007-08-08 EP disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
CN-1596119-A Modification of feeding behavior IMP COLLEGE INNOVATIONS LTD (GB) 2005-03-16 CN disclosed
CN-1168711-C Reversible aqueous pH sensitive lipidizing reagents, compositions and methods of use �ϼ��������Ǵ�ѧ 2004-09-29 CN disclosed
CN-1350519-A Reversible aqueous pH Sensitive lipidizing reagents, compositions and methods of use UNIV SOUTHERN CALIFORNIA (US) 2002-05-22 CN disclosed
US-6100292-A Ketone derivatives and their medical applications TORAY INDUSTRIES, INC. (JP) 2000-08-08 US disclosed
EP-0980867-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2000-02-23 EP disclosed
CN-1222510-A Arylacetic amide derivative or salt thereof, and pharmaceutical comprising it SSP CO LTD (JP) 1999-07-14 CN disclosed