SCHEMBL6058879

SCHEMBL6058879

CCCCCc1cccc(-c2ccc3ccc4cccc5ccc2c3c45)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.42
LIPG Q9Y5X9 3/20 0.42
TLR8 Q9NR97 1/20 0.39
GPR3 P46089 1/20 0.39
SPHK2 Q9NRA0 7/20 0.37
SPHK1 Q9NYA1 5/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 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
SCHEMBL6058898 0.86 TLR8 (0.43) TLR8ALDH1A1CYP3A4HPGDTSHR
SCHEMBL28830953 0.84 RARB (0.44) LPLLIPGTLR8GPR3ALDH1A1
SCHEMBL6059030 0.82 LPL (0.46) LPLLIPGSPHK2SPHK1CYP3A4
SCHEMBL4444137 0.81 HSD11B1 (0.40) TLR8ALDH1A1CYP3A4HPGDTSHR
Bromide SCHEMBL28136119 0.81 BDKRB2 (0.45) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL27744087 0.80 PTPN11 (0.33) TLR8ALDH1A1CYP3A4HPGDTSHR
SCHEMBL28215877 0.80 ALDH1A1 (0.32) ALDH1A1CYP3A4HPGDTSHRHSD17B10
SCHEMBL27744086 0.79 GPR3 (0.41) LPLLIPGGPR3ALDH1A1CYP3A4
SCHEMBL27811821 0.78 NOS1 (0.42) ALDH1A1CYP3A4HPGDTSHRHSD17B10
Bromide SCHEMBL28115757 0.77 CYP1A2 (0.39) ALDH1A1CYP3A4HPGDTSHRHSD17B10

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