SCHEMBL3962086

SCHEMBL3962086

CCCCc1cccc(C(C)C)c1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.39
TLR8 Q9NR97 3/20 0.38
BID P55957 3/20 0.37
MCL1 Q07820 3/20 0.37
BCL2L1 Q07817 2/20 0.37
BAK1 Q16611 2/20 0.37
KAT8 Q9H7Z6 2/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
EP300 Q09472 1/20 0.37
KAT2A Q92830 1/20 0.37
KAT2B Q92831 1/20 0.37
KAT5 Q92993 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
GABRA1 P14867 3/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRB2 P47870 2/20 0.36
FAAH O00519 1/20 0.36
CA1 P00915 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
SCHEMBL3962423 0.89 GABRA1 (0.39) SOAT1GABRA1GABRG2GABRB3GABRB2
SCHEMBL3676124 0.82 TLR8 (0.46) TLR8BIDMCL1BCL2L1BAK1
SCHEMBL29631719 0.81 GABRA1 (0.42) GABRA1GABRG2GABRB3GABRB2FAAH
SCHEMBL770339 0.81 GABRA1 (0.42) GABRA1GABRG2GABRB3GABRB2FAAH
SCHEMBL30436245 0.81 CYSLTR2 (0.46) SOAT1TLR8GABRA1GABRG2GABRB3
SCHEMBL5665256 0.81 CYSLTR2 (0.46) SOAT1TLR8GABRA1GABRG2GABRB3
SCHEMBL30159313 0.80 GABRA1 (0.47) SOAT1BIDMCL1BCL2L1BAK1
SCHEMBL28354022 0.80 GABRA1 (0.47) SOAT1BIDMCL1BCL2L1BAK1
SCHEMBL5608325 0.80 SOAT1 (0.40) SOAT1BIDMCL1BCL2L1BAK1
SCHEMBL3966567 0.79 TLR8 (0.43) TLR8BIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009038006-A1 RANDOM COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed