SCHEMBL8935320

SCHEMBL8935320

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCCCCCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.32
PTPN11 Q06124 3/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
THRA P10827 2/20 0.31
THRB P10828 2/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 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
SCHEMBL8935300 1.00 FPR2 (0.32) FPR2PTPN11ALOX5APFEN1THRA
SCHEMBL8935333 1.00 FPR2 (0.32) FPR2PTPN11ALOX5APFEN1THRA
SCHEMBL8935312 1.00 FPR2 (0.32) FPR2PTPN11ALOX5APFEN1THRA
SCHEMBL8935245 0.99 FPR2 (0.33) FPR2ALOX5APFEN1GABRA1GABRB2
SCHEMBL8962794 0.97 FPR2 (0.31) FPR2PTPN11
SCHEMBL8962624 0.97 FPR2 (0.31) FPR2PTPN11
SCHEMBL8962778 0.97 FPR2 (0.31) FPR2PTPN11
SCHEMBL8962743 0.97 FPR2 (0.31) FPR2PTPN11
SCHEMBL8962607 0.96 FPR2 (0.32) FPR2ALOX5APFEN1
SCHEMBL8935246 0.96 SCN9A (0.32) 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 1 patent. 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