SCHEMBL8937770

SCHEMBL8937770

CCCCCCCCCCc1ccc(-c2ccc(-c3ccc(C4=CCC(CCCCCCC)CC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.34
RARA P10276 1/20 0.34
RARG P13631 1/20 0.34
ESR2 Q92731 1/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2C8 P10632 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
S1PR3 Q99500 1/20 0.31
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
ALOX5 P09917 1/20 0.30
MAPT P10636 1/20 0.30
TYR P14679 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8937632 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937716 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937833 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937529 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937607 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937699 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937788 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937856 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937715 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4
SCHEMBL8937739 1.00 RARB (0.34) RARBRARARARGESR2CYP3A4

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed