SCHEMBL9664385

SCHEMBL9664385

CCCc1ccc(CCc2ccc(-c3ccc(CC)cc3F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.49
CHKA P35790 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
GRIA4 P48058 1/20 0.38
MAPT P10636 2/20 0.37
ALOX5 P09917 1/20 0.37
GFER P55789 1/20 0.37
S1PR1 P21453 2/20 0.37
S1PR3 Q99500 2/20 0.37
MCL1 Q07820 1/20 0.36
RARA P10276 1/20 0.36
RARG P13631 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
SCHEMBL10975918 0.98 RARB (0.50) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL16377212 0.97 RARB (0.49) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL16377207 0.95 RARB (0.48) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9664434 0.95 RARB (0.48) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9663386 0.95 RARB (0.48) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9664311 0.93 RARB (0.48) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9662918 0.93 RARB (0.51) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9664422 0.93 RARB (0.51) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL8391396 0.91 RARB (0.47) RARBCHKANPC1RAB9ASMN1; SMN2
SCHEMBL9399967 0.91 RARB (0.52) RARBCHKANPC1RAB9ASMN1; SMN2

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-5093026-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-03-03 US disclosed