SCHEMBL20006875

SCHEMBL20006875

CCCc1ccc(-c2cc(C)c(C#Cc3ccc(-c4ccc(-c5ccc(C)cc5)cc4)cc3F)c(F)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
MCL1 Q07820 1/20 0.33
AR P10275 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
FFAR1 O14842 2/20 0.31
FFAR4 Q5NUL3 2/20 0.31
HSD17B10 Q99714 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL20005191 0.93 RARB (0.42) RARBRARARARGCYP11B1CYP11B2
SCHEMBL19999459 0.92 RARB (0.43) RARBRARARARGMCL1HSD17B10
SCHEMBL19999547 0.91 RARB (0.47) RARBRARARARGHSD17B10MEN1
SCHEMBL20005190 0.88 CYP11B1 (0.40) CYP11B1CYP11B2ARCYP1A2MAPT
SCHEMBL20006853 0.88 FFAR1 (0.40) RARBRARARARGMCL1TAAR1
SCHEMBL25548582 0.81 FFAR1 (0.42) RARBRARARARGMCL1TAAR1
SCHEMBL20004483 0.81 TSHR (0.44) RARBRARARARGFFAR1HSD17B10
SCHEMBL19999418 0.80 RARB (0.34) RARBRARARARGMCL1FFAR1
SCHEMBL20047821 0.80 PYGL (0.37) RARBRARARARGCYP11B1CYP11B2
SCHEMBL19999463 0.80 TSHR (0.49) RARBRARARARGFFAR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed