SCHEMBL6058865

SCHEMBL6058865

CCCCCc1ccccc1-c1cccc2cc3ccccc3cc12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 9/20 0.43
LIPG Q9Y5X9 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
CNR2 P34972 1/20 0.41
MAPT P10636 1/20 0.41
CNR1 P21554 2/20 0.40
GPR3 P46089 1/20 0.39
ALOX5 P09917 1/20 0.39
PTGS2 P35354 1/20 0.39
KCNH2 Q12809 1/20 0.39
PPARA Q07869 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
Anthracene SCHEMBL28729629 0.87 TLR8 (0.48) TLR8LIPGMAPTALOX5PTGS2
SCHEMBL223486 0.87 TLR8 (0.48) TLR8LIPGMAPTALOX5PTGS2
SCHEMBL1610855 0.85 LIPG (0.50) TLR8LIPGMAPTKCNH2PPARA
SCHEMBL1612051 0.85 LIPG (0.50) TLR8LIPGMAPTKCNH2PPARA
SCHEMBL29006424 0.85 TLR8 (0.47) TLR8LIPGMAPTALOX5PTGS2
SCHEMBL9394658 0.85 LIPG (0.50) TLR8LIPGMAPTKCNH2PPARA
SCHEMBL1611673 0.85 LIPG (0.50) TLR8LIPGMAPTKCNH2PPARA
SCHEMBL6058810 0.85 CNR1 (0.49) TLR8LIPGNR1H2NR1H3CNR2
SCHEMBL9228217 0.85 LIPG (0.50) TLR8LIPGMAPTKCNH2PPARA
SCHEMBL1025768 0.85 TLR8 (0.47) TLR8LIPGMAPTALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268588-A4 ETHYLENE-AROMATIC VINYL COMPOUND-VINYL NORBONENE TERPOLYMER SAMSUNG ATOFINA CO LTD (KR) 2006-03-29 EP disclosed
EP-1268588-A1 ETHYLENE-AROMATIC VINYL COMPOUND-VINYL NORBONENE TERPOLYMER Samsung General Chemicals Co., Ltd. (KR) 2003-01-02 EP disclosed
WO-2001046282-A1 ETHYLENE-AROMATIC VINYL COMPOUND-VINYL NORBONENE TERPOLYMER SAMSUNG GENERAL CHEMICALS CO., LTD. (KR) 2001-06-28 WO disclosed