SCHEMBL2745162

SCHEMBL2745162

c1ccc(-c2cscc2-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.68
CYP2B6 P20813 3/20 0.68
PTGS2 P35354 3/20 0.59
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
CYP2E1 P05181 2/20 0.48
ALDH1A1 P00352 4/20 0.47
BACE1 P56817 1/20 0.46
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.43
BCL2L1 Q07817 1/20 0.43
MAPK1 P28482 1/20 0.43
NOTUM Q6P988 1/20 0.41
TDO2 P48775 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALOX5 P09917 1/20 0.39
DPP4 P27487 1/20 0.39

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
SCHEMBL12270243 0.92 CYP2A6 (0.60) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL28594930 0.85 CYP2A6 (0.54) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL31618783 0.85 CYP2A6 (0.65) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL9672144 0.82 CYP2A6 (0.56) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL13271568 0.82 CYP2A6 (0.56) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL3609702 0.82 CYP2A6 (1.00) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL14965301 0.82 CYP2A6 (0.56) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL544160 0.82 CYP2A6 (0.56) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL31091243 0.82 CYP2A6 (0.56) CYP2A6CYP2B6PTGS2ESR1ESR2
SCHEMBL6050762 0.80 IDO1 (0.50) CYP2A6CYP2B6PTGS2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109053740-A A kind of H-type acceptor material and preparation method thereof 南京邮电大学 2018-12-21 CN claimed
US-7321012-B2 Method of crosslinking intrinsically conductive polymers or intrinsically conductive polymer precursors and the articles obtained therefrom THE UNIVERSITY OF CONNECTICUT (US) 2008-01-22 US claimed
WO-2005014693-A1 METHOD OF CROSSLINKING INTRINSICALLY CONDUCTIVE POLYMERS OR INTRINSICALLY CONDUCTIVE POLYMER PRECURSORS AND THE ARTICLES OBTAINED THEREFROM UNIVERSITY OF CONNECTICUT (US) 2005-02-17 WO claimed
US-20040242792-A1 Method of crosslinking intrinsically conductive polymers or intrinsically conductive polymer precursors and the articles obtained therefrom CONNECTICUT, THE UNIVERSITY OF 2004-12-02 US claimed
JP-63160879-A None JP disclosed
CN-120136839-A Method for synthesizing polysubstituted thiophene compounds 南京理工大学 2025-06-13 CN disclosed
CN-109053740-A A kind of H-type acceptor material and preparation method thereof 南京邮电大学 2018-12-21 CN disclosed
US-9466432-B2 Process for producing solution having electrically conductive polymer dispersed therein, and electrolytic capacitor PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2016-10-11 US disclosed
US-9401245-B2 2016-07-26 US disclosed
US-20140170405-A1 PROCESSES FOR PREPARING CURED FILMS, THE RESULTING FILMS, AND PLASMA-INITIATED POLYMERIZABLE COMPOSITIONS FUJIFILM CORPORATION (JP) 2014-06-19 US disclosed
EP-1548044-B1 Method of preparing derivatives of polyarylene vinylene and method of preparing an electronic device including same IMEC (BE) 2013-07-03 EP disclosed
US-20120196078-A1 CONJUGATED POLYMER FIBER, PREPARATION AND USE THEREOF SOTZING GREGORY A (US) 2012-08-02 US disclosed
US-6242561-B1 USED AS SEMICONDUCTORS; ELECTROCHROMIC AND ANTISTATIC PROPERTIES BASF AKTIENGESELLSCHAFT (DE) 2001-06-05 US disclosed
EP-0885251-A1 SUBSTITUTED POLYTHIOPHENES, PROCESSES FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-12-23 EP disclosed
WO-1997032914-A1 SUBSTITUTED POLYTHIOPHENES, PROCESSES FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1997-09-12 WO disclosed
US-5558904-A Electroluminescent devices containing a conjugated polymer obtained via halogen precursor route chemistry XEROX CORPORATION (US) 1996-09-24 US disclosed
JP-S63160879-A THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD 1988-07-04 JP disclosed
US-4739075-A Reactive end-capping agent, addition-curable quinoxaline resin oligomer and intermediate material for fiber-reinforced composite DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) 1988-04-19 US disclosed
US-4670536-A Addition-curable quinoxaline resin oligomer and intermediate material for fiber-reinforced composite DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1987-06-02 US disclosed
US-4174405-A MITICIDES UNIROYAL, INC. (US) 1979-11-13 US disclosed