SCHEMBL19985552

SCHEMBL19985552

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

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
IKBKB O14920 3/20 0.31
FPR2 P25090 3/20 0.31
MCHR1 Q99705 1/20 0.31
SCN9A Q15858 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL19985549 1.00 THRA (0.32) THRATHRBIKBKBFPR2MCHR1
SCHEMBL19985542 1.00 THRA (0.32) THRATHRBIKBKBFPR2MCHR1
SCHEMBL19985543 1.00 THRA (0.32) THRATHRBIKBKBFPR2MCHR1
SCHEMBL19985539 0.99 FPR2 (0.32) THRATHRBIKBKBFPR2MCHR1
SCHEMBL19985540 0.96 SCN9A (0.34) FPR2SCN9AALOX5APFEN1
SCHEMBL8935312 0.95 FPR2 (0.32) THRATHRBFPR2ALOX5APFEN1
SCHEMBL8935333 0.95 FPR2 (0.32) THRATHRBFPR2ALOX5APFEN1
SCHEMBL8935320 0.95 FPR2 (0.32) THRATHRBFPR2ALOX5APFEN1
SCHEMBL8935300 0.95 FPR2 (0.32) THRATHRBFPR2ALOX5APFEN1
SCHEMBL8935245 0.94 FPR2 (0.33) FPR2SCN9ACNR1CNR2ALOX5AP

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