SCHEMBL8935622

SCHEMBL8935622

C=CCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.33
ALOX5AP P20292 3/20 0.32
FEN1 P39748 3/20 0.32
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
FFAR4 Q5NUL3 2/20 0.31
GABRA1 P14867 2/20 0.30
GABRB2 P47870 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
SCHEMBL8963066 0.97 FPR2 (0.32) FPR2ALOX5APFEN1FGFR1FGFR2
SCHEMBL19985566 0.94 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL8935632 0.93 GABRA1 (0.38) FPR2ALOX5APFEN1FFAR4GABRA1
SCHEMBL3911932 0.92 OPRL1 (0.32)
SCHEMBL3911928 0.92 OPRL1 (0.32)
SCHEMBL8935635 0.92 CNR2 (0.35) FPR2ALOX5APFEN1GABRA1GABRB2
SCHEMBL8934687 0.91 FFAR4 (0.37) FPR2FGFR1FGFR2GRIN1GRIN2B
SCHEMBL8935646 0.91 GABRA1 (0.35) FPR2ALOX5APFEN1GABRA1GABRB2
SCHEMBL13000745 0.90
SCHEMBL8935616 0.90 ALOX5AP (0.35) FPR2ALOX5APFEN1

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
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
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