SCHEMBL28087738

SCHEMBL28087738

COCC(Cc1ccccc1)C(C)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.44
TAAR1 Q96RJ0 5/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
MAOA P21397 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
SLC18A2 Q05940 1/20 0.41
CYP2D6 P10635 1/20 0.41
TRPA1 O75762 2/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
HTR2A P28223 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRK1 P41145 1/20 0.38
KCNH2 Q12809 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
SCHEMBL12458540 0.88 SIGMAR1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL8734162 0.86 SIGMAR1 (0.46) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL12788164 0.85 TRPA1 (0.47) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL11991409 0.85 TRPA1 (0.47) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL28087864 0.79 THRB (0.40) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL358968 0.76 SIGMAR1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL12534489 0.76 SIGMAR1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL8240630 0.76 SIGMAR1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL2355328 0.76 SIGMAR1 (0.50) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3
Ammonia Solution, Strong SCHEMBL6014633 0.75 SIGMAR1 (0.48) SIGMAR1TAAR1SLC6A2SLC6A4SLC6A3

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110016097-A A kind of low leachable, low melting point, Narrow Molecular Weight Distribution, ethylene-propylene random copolymer of thermal oxidation stability and its preparation method and application 中国石油化工股份有限公司 2019-07-16 CN disclosed
CN-109694420-A Catalyst system and pre-polymerized catalyst and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-30 CN disclosed
CN-109694426-A A kind of polypropylene and preparation method thereof 中国石油化工股份有限公司 2019-04-30 CN disclosed
CN-109422834-A A kind of low VOC, high just high flow polypropylene and preparation method thereof 中国石油化工股份有限公司 2019-03-05 CN disclosed
CN-109422958-A A kind of high flowing high-rigidity high-ductility polyolefin composition and preparation method thereof 中国石油化工股份有限公司 2019-03-05 CN disclosed
CN-109422959-A A kind of impact polypropylene composition and preparation method thereof 中国石油化工股份有限公司 2019-03-05 CN disclosed
CN-104974285-B A kind of polypropylene catalyst method for preparing ingredients thereof and catalyst 中国石油化工股份有限公司 2017-08-22 CN disclosed
CN-104974286-B Catalytic component and catalyst for propylene polymerization 中国石油化工股份有限公司 2017-08-22 CN disclosed
CN-105940019-A CATALYST SYSTEM FOR POLYMERIZATION OF AN OLEFIN 沙特基础工业公司 2016-09-14 CN disclosed
CN-105940018-A Procatalyst for polymerization of olefins 沙特基础工业公司 2016-09-14 CN disclosed
CN-105940021-A Catalyst system for olefin polymerization 沙特基础工业公司 2016-09-14 CN disclosed
CN-105934449-A Catalyst system for polymerization of olefin 沙特基础工业公司 2016-09-07 CN disclosed