SCHEMBL1777142

SCHEMBL1777142

CCc1cc[c]c(C(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
TRPA1 O75762 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL1776652 0.84 CNR1 (0.37)
SCHEMBL165772 0.82 GABRA1 (0.40) CYP1A2TRPA1ALDH1A1LMNAMAPT
SCHEMBL27730438 0.82 CSNK2A1 (0.36) CYP2A6ALDH1A1SMN1; SMN2NOS3NOS1
SCHEMBL27876542 0.81 SKP2 (0.40) CYP1A2NPC1ALDH1A1MAPK1RAB9A
SCHEMBL11442367 0.76 ESR1 (0.34)
SCHEMBL15067982 0.73 TRPA1 (0.39) CYP1A2CYP2A6TRPA1NPC1ALDH1A1
SCHEMBL11504249 0.73 PTGS2 (0.33) CYP1A2CYP2A6TRPA1NOS3NOS1
SCHEMBL1778312 0.72 TRPA1 (0.32) CYP1A2CYP2A6TRPA1NPC1ALDH1A1
SCHEMBL311359 0.71 TRPA1 (0.38) CYP1A2CYP2A6TRPA1NPC1ALDH1A1
SCHEMBL677008 0.71 LMNA (0.37) TRPA1ALDH1A1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636955-A Tetrazolinone compound and use thereof SUMITOMO CHEMICAL CO 2016-06-01 CN disclosed
CN-104245689-A Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL CO 2014-12-24 CN disclosed
CN-101519469-B Diene polymer and production process thereof SUMITOMO CHEMICAL CO 2013-06-12 CN disclosed
CN-101255214-B Diene polymer and process for producing the same SUMITOMO CO LTD 2013-01-02 CN disclosed
US-8188202-B2 Making polymers based on monomer 9,9-Diallylfluorene; diallyl groups form cyclohexane ring upon polymerization; superior heat resistance; use of diimine-based nickel complex catalyst, organoaluminum, and boron compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-29 US disclosed
US-7964691-B2 5,5-diallyl-2,2-dimethyl-1,3-dioxane as monomer units; polymerization catalysts; heat resistance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-21 US disclosed
US-7956145-B2 Polymerization of 1,6-heptadiene in the presence of a catalyst formed by contacting a transition metal with a diimino aluminum or boron compound, giving a polymer structure of alternating ethylene and cyclopentene; superior balance between a heat resistance and workability SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-07 US disclosed
US-7943715-B2 Polymerization of 1,6-heptadiene in the presence of a catalyst formed by contacting a transition metal with a diimino aluminum or boron compound, giving a polymer structure of alternating ethylene and cyclopentene; superior balance between a heat resistance and workability SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-17 US disclosed
US-7799886-B2 Diene polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-21 US disclosed
US-20100234546-A1 DIENE POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
US-20080214755-A1 OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
US-20080214754-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
CN-101255213-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255209-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255212-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255221-A Olefin-diene copolymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255210-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255214-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
CN-101255211-A Diene polymer and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
US-4042567-A S-Triazine prepolymers and a process for their production BAYER AKTIENGESELLSCHAFT (DT) 1977-08-16 US disclosed