SCHEMBL3811256

SCHEMBL3811256

C=CC(Cl)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.44
TAAR1 Q96RJ0 5/20 0.41
SLC6A2 P23975 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
MAOA P21397 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CYP2A6 P11509 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
CYP1A2 P05177 1/20 0.40
SLC18A2 Q05940 1/20 0.39
ANPEP P15144 1/20 0.39
CYP2D6 P10635 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALPI P09923 1/20 0.38
PKM P14618 1/20 0.38
PTGS1 P23219 1/20 0.38
XIAP P98170 1/20 0.38

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
SCHEMBL10798807 0.80 SLC6A4 (0.50) TAAR1SLC6A2SLC6A4SLC6A3CYP2A6
SCHEMBL6016111 0.78 MMP13 (0.40) TAAR1SLC6A2SLC6A4SLC6A3CYP2A6
SCHEMBL10800348 0.78 PNMT (0.55) TAAR1SLC6A2SIGMAR1SLC6A4
SCHEMBL9171307 0.77 CYP1A2 (0.45) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL3045013 0.77 EPHX1 (0.50) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL15317143 0.77 EPHX1 (0.50) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL1061707 0.76 EPHX1 (0.48) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL11403698 0.76 EPHX1 (0.43) EPHX1TAAR1SLC6A2SIGMAR1MAOA
SCHEMBL11403706 0.76 EPHX1 (0.43) EPHX1TAAR1SLC6A2SIGMAR1MAOA
Ammonia Solution, Strong SCHEMBL11773949 0.75 EPHX1 (0.39) EPHX1TAAR1SLC6A2SIGMAR1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105330662-B Preparation of imidazole type ionic liquid derived by cinchona alkaloid 华东师范大学 2017-05-24 CN claimed
CN-105330662-A Preparation of imidazole type ionic liquid derived by cinchona alkaloid UNIV EAST CHINA NORMAL 2016-02-17 CN claimed
CN-112300495-A Silicon dioxide and propane-butadiene copolymer compound and preparation method thereof 中国石油天然气股份有限公司 2021-02-02 CN disclosed
CN-105330662-B Preparation of imidazole type ionic liquid derived by cinchona alkaloid 华东师范大学 2017-05-24 CN disclosed
CN-105330662-A Preparation of imidazole type ionic liquid derived by cinchona alkaloid UNIV EAST CHINA NORMAL 2016-02-17 CN disclosed
CN-1882595-B Methods for producing copper ethanolamine solutions ARCH CHEM INC 2011-06-08 CN disclosed
US-7857906-B2 Fiber reinforced cement composite materials using chemically treated fibers with improved dispersibility James Hardie Technology Limited (IE) 2010-12-28 US disclosed
US-20080148999-A1 Fiber reinforced cement composite materials using chemically treated fibers with improved dispersibility JAMES HARDIE RESEARCH PTY LIMITED (AU) 2008-06-26 US disclosed
US-7344593-B2 Fiber reinforced cement composite materials using chemically treated fibers with improved dispersibility JAMES HARDIE INTERNATIONAL FINANCE B.V. (NL) 2008-03-18 US disclosed
EP-1829845-A2 Fiber reinforced cement composite materials using chemically treated fibers with improved dispersibility James Hardie International Finance N.V. (NL) 2007-09-05 EP disclosed
CN-1956710-A Methods to relief pain IMP INNOVATIONS LTD (GB) 2007-05-02 CN disclosed
EP-0456090-B1 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF AG (DE) 1994-07-13 EP disclosed
EP-0368227-B1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1993-01-27 EP disclosed
CN-1017057-B ANTIFOULING COMPOSITION AND PROCESS FOR PREPARING SAME AND USED WAITOMO IND INVESTMENTS (CA) 1992-06-17 CN disclosed
US-5076831-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1991-12-31 US disclosed
EP-0456090-A2 Herbicidal agents containing cyclohexenone derivatives as active ingredients and naphthalene derivatives as antidotes BASF Aktiengesellschaft (DE) 1991-11-13 EP disclosed
US-5022914-A Pre- and post-emergence; broad leaf plants; rice BASF AKTIENGESELLSCHAFT (DE) 1991-06-11 US disclosed
EP-0430004-A2 1,8-Naphthalimides as antidotes BASF Aktiengesellschaft (DE) 1991-06-05 EP disclosed
EP-0368227-A1 Cyclohexenone oxime ethers, process for their preparation and their use as herbicides BASF Aktiengesellschaft (DE) 1990-05-16 EP disclosed
CN-1039829-A ANTIFOULING COMPOSITION WAITOMO IND INVESTMENTS (CA) 1990-02-21 CN disclosed