SCHEMBL15722951

SCHEMBL15722951

CCCC/C=C/Oc1ccc(-c2ccc(CCC)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.35
GABRB2 P47870 3/20 0.35
RARB P10826 2/20 0.34
MPL P40238 8/20 0.34
LTA4H P09960 1/20 0.31
ALOX5 P09917 1/20 0.31
HSD11B1 P28845 1/20 0.30
TNNC1 P63316 1/20 0.30
CTSL P07711 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 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
SCHEMBL15722952 0.96 RARB (0.36) GABRA1GABRB2RARBMPLLTA4H
SCHEMBL15722953 0.95 RARB (0.38) GABRA1GABRB2RARBMPLLTA4H
SCHEMBL15722949 0.92 MPL (0.32) GABRA1GABRB2RARBMPLALOX5
SCHEMBL15722950 0.88 GABRA1 (0.33) GABRA1GABRB2RARBMPLALOX5
SCHEMBL15722912 0.84 MPL (0.33) GABRA1GABRB2RARBMPLALOX5
SCHEMBL15722971 0.82 CTSS (0.46) GABRA1GABRB2CTSLCTSSCTSK
SCHEMBL15722942 0.82 MPL (0.39) RARBMPLHSD11B1
SCHEMBL15722943 0.81 RARB (0.43) RARBMPLHSD11B1
SCHEMBL20273257 0.80 THRB (0.37) GABRA1GABRB2RARBMPLALOX5
SCHEMBL15722944 0.80 RARB (0.44) RARBHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed