SCHEMBL19985539

SCHEMBL19985539

C/C=C/C1CCC(c2ccc(-c3ccc(OCCCCC)c(F)c3F)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.32
SCN9A Q15858 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
IKBKB O14920 3/20 0.30
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30
MCHR1 Q99705 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
SCHEMBL19985552 0.99 THRA (0.32) FPR2SCN9AALOX5APFEN1IKBKB
SCHEMBL19985543 0.99 THRA (0.32) FPR2SCN9AALOX5APFEN1IKBKB
SCHEMBL19985549 0.99 THRA (0.32) FPR2SCN9AALOX5APFEN1IKBKB
SCHEMBL19985542 0.99 THRA (0.32) FPR2SCN9AALOX5APFEN1IKBKB
SCHEMBL19985540 0.97 SCN9A (0.34) FPR2SCN9AALOX5APFEN1HTR1D
SCHEMBL8935245 0.95 FPR2 (0.33) FPR2SCN9AALOX5APFEN1
SCHEMBL8935333 0.94 FPR2 (0.32) FPR2ALOX5APFEN1THRATHRB
SCHEMBL8935320 0.94 FPR2 (0.32) FPR2ALOX5APFEN1THRATHRB
SCHEMBL8935312 0.94 FPR2 (0.32) FPR2ALOX5APFEN1THRATHRB
SCHEMBL8935300 0.94 FPR2 (0.32) FPR2ALOX5APFEN1THRATHRB

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-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed