SCHEMBL8947422

SCHEMBL8947422

C=CC1CCC(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2F)CO1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 12/20 0.36
GABRA1 P14867 3/20 0.32
GABRB2 P47870 3/20 0.32
FGFR1 P11362 1/20 0.31
FGFR2 P21802 1/20 0.31
HTR2C P28335 4/20 0.31
HTR2B P41595 2/20 0.31
HTR2A P28223 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
SCHEMBL12023997 0.95 FPR2 (0.38) FPR2HTR2CHTR2BHTR2A
SCHEMBL8947428 0.93 GABRA1 (0.39) FPR2GABRA1GABRB2HTR2CHTR2B
SCHEMBL13573422 0.92 HTR2C (0.34) FPR2HTR2CHTR2BHTR2A
SCHEMBL8947434 0.92 CNR2 (0.36) FPR2GABRA1GABRB2HTR2C
SCHEMBL18719251 0.92 FPR2 (0.38) FPR2GABRA1GABRB2
SCHEMBL8945926 0.91 FPR2 (0.34) FPR2GABRA1GABRB2FGFR1FGFR2
SCHEMBL8947437 0.91 GABRA1 (0.36) FPR2GABRA1GABRB2
SCHEMBL18718456 0.91 FPR2 (0.36) FPR2GABRA1GABRB2FGFR1FGFR2
SCHEMBL12024500 0.91 FPR2 (0.32) FPR2
SCHEMBL13579235 0.90 FPR2 (0.36) FPR2GABRA1GABRB2HTR2CHTR2B

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-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
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