SCHEMBL19985457

SCHEMBL19985457

CCOc1ccc(-c2ccc(C3CCC(C)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 6/20 0.36
ALDH1A1 P00352 1/20 0.34
KDM1A O60341 2/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
ALOX5AP P20292 9/20 0.33
FEN1 P39748 9/20 0.33
SCN9A Q15858 1/20 0.32

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
SCHEMBL12156539 0.94 ALDH1A1 (0.37) FPR2ALDH1A1KDM1ASCN9A
SCHEMBL15381624 0.94 FPR2 (0.39) FPR2KDM1AFGFR1FGFR2ALOX5AP
SCHEMBL12733628 0.94 ALDH1A1 (0.37) FPR2ALDH1A1KDM1ASCN9A
SCHEMBL19985460 0.91 FPR2 (0.39) FPR2ALOX5APFEN1
SCHEMBL4406888 0.90 ALDH1A1 (0.38) FPR2ALDH1A1KDM1ASCN9A
SCHEMBL15381547 0.90 ALDH1A1 (0.38) FPR2ALDH1A1KDM1ASCN9A
SCHEMBL14922522 0.90 FPR2 (0.37) FPR2KDM1AFGFR1FGFR2ALOX5AP
SCHEMBL13000032 0.90 FPR2 (0.35) FPR2ALDH1A1KDM1AFGFR1FGFR2
SCHEMBL19985458 0.89 SCN9A (0.36) FPR2ALOX5APFEN1SCN9A
SCHEMBL21478420 0.89 ALOX5AP (0.35) ALDH1A1KDM1AALOX5APFEN1

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