SCHEMBL20202972

SCHEMBL20202972

CCCc1ccc(CCc2ccc(-c3ccc(C4CCC(C)CC4)cc3F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.47
RARB P10826 1/20 0.40
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 2/20 0.38
APP P05067 2/20 0.38
SPHK1 Q9NYA1 6/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
HTR2A P28223 1/20 0.36
GRM2 Q14416 1/20 0.36
ESR2 Q92731 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MPL P40238 1/20 0.34

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
SCHEMBL19820860 0.93 FASN (0.47) FASNRARBCYP3A4CYP2C9APP
SCHEMBL20202974 0.92 FASN (0.47) FASNRARBCYP3A4CYP2C9APP
SCHEMBL16286047 0.91 FASN (0.42) FASNRARBCYP3A4CYP2C9APP
SCHEMBL13245999 0.91 FASN (0.42) FASNRARBCYP3A4CYP2C9APP
SCHEMBL19820865 0.90 FASN (0.45) FASNRARBCYP3A4CYP2C9APP
SCHEMBL9662806 0.89 RARB (0.39) FASNRARBCYP3A4CYP2C9APP
SCHEMBL19820868 0.89 FASN (0.44) FASNRARBCYP3A4CYP2C9APP
SCHEMBL20202975 0.89 RARB (0.39) FASNRARBCYP3A4CYP2C9APP
SCHEMBL20209854 0.88 FASN (0.45) FASNRARBCYP3A4CYP2C9APP
SCHEMBL9662846 0.88 CYP2C9 (0.40) FASNRARBCYP3A4CYP2C9APP

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
US-20180148647-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAME DIC CORPORATION (JP) 2018-05-31 US disclosed