SCHEMBL15722973

SCHEMBL15722973

CCCCCC/C=C/Oc1ccc(-c2ccc(CCC)c(F)c2F)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.44
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
CNR1 P21554 2/20 0.32
LTA4H P09960 1/20 0.31
MMP2 P08253 2/20 0.30
F7 P08709 2/20 0.30
F3 P13726 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
ECE1 P42892 1/20 0.30
SGMS1 Q86VZ5 1/20 0.30
SGMS2 Q8NHU3 1/20 0.30
MUS81 Q96NY9 1/20 0.30
HSD17B10 Q99714 1/20 0.30
SAE1 Q9UBE0 1/20 0.30
HTR1A P08908 2/20 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
SCHEMBL15722972 0.99 CTSS (0.45) CTSLCTSSCTSKCNR1LTA4H
SCHEMBL15722971 0.95 CTSS (0.46) CTSLCTSSCTSK
SCHEMBL15722970 0.90 CTSS (0.48) CTSLCTSSCTSK
SCHEMBL15722968 0.85 CTSS (0.49) CTSLCTSSCTSK
SCHEMBL15722953 0.83 RARB (0.38) CNR1LTA4HHTR1A
SCHEMBL15722964 0.82 CTSS (0.41) CTSLCTSSCTSKMAPTALOX15
SCHEMBL15722952 0.81 RARB (0.36) CNR1LTA4HHTR1A
SCHEMBL15722960 0.81 CTSS (0.50) CTSLCTSSCTSK
SCHEMBL15722962 0.79 CTSS (0.42) CTSLCTSSCTSK
SCHEMBL15722951 0.78 GABRA1 (0.35) CTSLCTSSCTSKLTA4H

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-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