SCHEMBL9015592

SCHEMBL9015592

C/C=C/CCC1CCC(c2ccc(-c3ccc(-c4ccc(O)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.33
FEN1 P39748 3/20 0.33
DGAT1 O75907 1/20 0.31

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
SCHEMBL9019812 0.97 ALOX5AP (0.32) ALOX5APFEN1
SCHEMBL13250716 0.92 OPRL1 (0.33)
SCHEMBL9015421 0.91 DGAT1 (0.38) ALOX5APFEN1DGAT1
SCHEMBL4561576 0.88 OPRL1 (0.32)
SCHEMBL9019317 0.88 DGAT1 (0.36) DGAT1
SCHEMBL8935349 0.87 OPRL1 (0.34) DGAT1
SCHEMBL8935400 0.85 DGAT1 (0.30) DGAT1
SCHEMBL15255897 0.84 CYP2C9 (0.36) ALOX5APFEN1DGAT1
SCHEMBL8962809 0.84 OPRL1 (0.33)
SCHEMBL8935500 0.84 ALOX5AP (0.34) ALOX5APFEN1

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