SCHEMBL20202986

SCHEMBL20202986

CCCc1ccc(-c2ccc(-c3ccc(CCc4ccc(CC)cc4)cc3)c(F)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.47
RARA P10276 1/20 0.43
RARG P13631 1/20 0.43
MCL1 Q07820 1/20 0.41
TAAR1 Q96RJ0 2/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
TP53 P04637 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KIF11 P52732 1/20 0.37
GRIA4 P48058 1/20 0.36
CHKA P35790 1/20 0.36
MAOB P27338 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALOX5 P09917 1/20 0.36
MAPT P10636 1/20 0.36
GFER P55789 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
SCHEMBL20202973 1.00 RARB (0.47) RARBRARARARGMCL1TAAR1
SCHEMBL11957382 0.98 RARB (0.48) RARBRARARARGMCL1TAAR1
SCHEMBL9999852 0.98 RARB (0.48) RARBRARARARGMCL1TAAR1
SCHEMBL30232659 0.98 RARB (0.48) RARBRARARARGMCL1TAAR1
SCHEMBL20209761 0.95 RARB (0.47) RARBRARARARGTAAR1KIF11
SCHEMBL20202978 0.95 RARB (0.50) RARBRARARARGMCL1TAAR1
SCHEMBL10603849 0.93 RARB (0.51) RARBRARARARGMCL1TAAR1
SCHEMBL9512294 0.93 RARB (0.51) RARBRARARARGMCL1TAAR1
SCHEMBL9664434 0.92 RARB (0.48) RARBMCL1TAAR1NPC1RAB9A
SCHEMBL9663386 0.92 RARB (0.48) RARBMCL1TAAR1NPC1RAB9A

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