SCHEMBL20006707

SCHEMBL20006707

CCCCc1ccc(C#Cc2c(C)cc(-c3ccc(-c4ccc5cc(-c6ccccc6)ccc5c4)cc3)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.41
RARA P10276 2/20 0.41
RARG P13631 1/20 0.41
HSD11B1 P28845 2/20 0.40
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HRH3 Q9Y5N1 3/20 0.37
PSMB5 P28074 1/20 0.36
FFAR1 O14842 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCHE P06276 2/20 0.34
ASIC3 Q9UHC3 1/20 0.34
DHODH Q02127 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
SCHEMBL20006836 0.96 RARB (0.39) RARBRARARARGHSD11B1TSHR
SCHEMBL20006753 0.95 RARB (0.37) RARBRARARARGHSD11B1TSHR
SCHEMBL19999618 0.94 TSHR (0.46) RARBRARARARGTSHRHSD17B10
SCHEMBL20006854 0.93 RARB (0.38) RARBRARARARGHSD11B1TSHR
SCHEMBL20005244 0.93 RARB (0.40) RARBRARARARGTSHRHSD17B10
SCHEMBL20004889 0.92 RARB (0.39) RARBRARARARGTSHRHSD17B10
SCHEMBL19999492 0.92 TSHR (0.44) RARBRARARARGTSHRHSD17B10
SCHEMBL19999412 0.90 TSHR (0.42) RARBRARARARGTSHRHSD17B10
SCHEMBL19999623 0.89 RARB (0.38) RARBRARARARGTSHRHSD17B10
SCHEMBL19999460 0.88 TSHR (0.43) RARBRARARARGTSHRHSD17B10

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