SCHEMBL4456341

SCHEMBL4456341

C=Cc1ccc(-c2ccccc2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
MCL1 Q07820 1/20 0.39
TRPA1 O75762 1/20 0.38
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CTSD P07339 1/20 0.38
BACE1 P56817 1/20 0.38
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 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
SCHEMBL29551674 0.82 CA12 (0.61) CA12CA1CA2CA9ALDH1A1
SCHEMBL3633054 0.82 CA12 (0.61) CA12CA1CA2CA9ALDH1A1
SCHEMBL23198145 0.81 CA12 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL7876591 0.81 CA12 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL8759106 0.80 ALDH1A1 (0.59) CA1ALDH1A1TSHRHDAC2TP53
SCHEMBL29551646 0.79 CA12 (0.59) CA12CA1CA2CA9ALDH1A1
SCHEMBL4541662 0.79 CA12 (0.59) CA12CA1CA2CA9ALDH1A1
SCHEMBL1313610 0.79 CA12 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL29438438 0.79 CA12 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL7932390 0.79 TP53 (0.52) CA12CA1CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118388883-A Propylene-based resin material, and preparation method and application thereof 中国石油天然气股份有限公司 2024-07-26 CN claimed
EP-2821418-B1 HYDROGENATED AROMATIC ALKENYL AND DIENE COPOLYMERS CONTAINING COMONOMERS THAT HAVE SILYL HYDRIDE UNITS AND FUNCTIONALIZED ANALOGUES THEREOF DYNASOL ELASTÓMEROS S A (ES) 2017-03-15 EP claimed
US-9238765-B2 Hydrogenated alkenyl aromatic-diene copolymers containing comonomers having silyl hydride units and their functionalized analogs DYNASOL ELASTOMEROS, S.A. (ES) 2016-01-19 US claimed
US-20150175854-A1 HYDROGENATED ALKENYL AROMATIC-DIENE COPOLYMERS CONTAINING COMONOMERS HAVING SILYL HYDRIDE UNITS AND THEIR FUNCTIONALIZED ANALOGS THE UNIVERSITY OF AKRON (US) 2015-06-25 US claimed
EP-2821418-A1 HYDROGENATED AROMATIC ALKENYL AND DIENE COPOLYMERS CONTAINING COMONOMERS THAT HAVE SILYL HYDRIDE UNITS AND FUNCTIONALIZED ANALOGUES THEREOF Dynasol Elastómeros S.A. (ES) 2015-01-07 EP claimed
US-20030114612-A1 Coupled diene polymers modified with electrophilic groups BAYER AKTIENGESELLSCHAFT (DE) 2003-06-19 US claimed
US-6225415-B1 SUPPLYING ANIONICALLY POLYMERIZABLE MONOMER, ADDING ANIONIC POLYMERIZATION INITIATOR TO FORM ANIONICALLY TERMINATED POLYMER CHAIN; ADDING FUNCTIONAL MONOMER TO ADD SINGLE UNIT OF FUNCTIONAL MONOMER UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE 2001-05-01 US claimed
US-6136921-A ALKALI METAL-TERMINATED POLYMER REACTED WITH DIGLYCIDYL ETHER DERIVATIVE COUPLING AGENT; CORROSION AND WEAR RESISTANCE; RADIATION TRANSPARENT TAIWAN SYNTHETIC RUBBER CORPERATION (TW) 2000-10-24 US claimed
EP-0666872-B1 PROCESS FOR PREPARING EPOXY-TERMINATED POLYMERS EASTMAN CHEM CO (US) 1996-12-27 EP claimed
EP-0666872-A1 PROCESS FOR PREPARING EPOXY-TERMINATED POLYMERS. EASTMAN CHEM CO (US) 1995-08-16 EP claimed
WO-1994010209-A1 PROCESS FOR PREPARING EPOXY-TERMINATED POLYMERS EASTMAN CHEMICAL COMPANY (US) 1994-05-11 WO claimed
US-5266644-A Process for preparing epoxy-terminated polymers EASTMAN KODAK COMPANY (US) 1993-11-30 US claimed
US-4168286-A THERMOPLASTIC ELASTOMERS, GREEN TENSILE STRENGTH, OZONE RESISTANCE PHILLIPS PETROLEUM CO. (US) 1979-09-18 US claimed
US-4163765-A VINYLARENE-CONJUGATED DIENE BLOCK COPOLYMER PHILLIPS PETROLEUM COMPANY (US) 1979-08-07 US claimed
US-4076914-A ORGANO-POLYHALIDE-COUPLED CONJUGATED DIENE POLYMER TREATED WITH AN ORGANO-METAL PHILLIPS PETROLEUM COMPANY (US) 1978-02-28 US claimed
US-4027041-A Ethyl- and vinylbenzenes as antithrombotic agents ELI LILLY AND COMPANY (US) 1977-05-31 US claimed
US-4024284-A Ethyl- and vinylbenzenes as anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-05-17 US claimed
CN-118388883-A Propylene-based resin material, and preparation method and application thereof 中国石油天然气股份有限公司 2024-07-26 CN disclosed
US-3975542-A Ethyl- and vinylbenzenes as antithromobiotic agents ELI LILLY AND COMPANY (US) 1976-08-17 US disclosed
US-3975543-A Ethyl- and vinylbenzenes as anti-inflammatory agents ELI LILLY AND COMPANY (US) 1976-08-17 US disclosed