SCHEMBL7733175

SCHEMBL7733175

CCCCCc1ccc(C(F)(F)Oc2ccc(-c3cc(F)c(F)c(F)c3)cc2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.42
RARA P10276 2/20 0.42
RARG P13631 1/20 0.42
KIF11 P52732 1/20 0.36
S1PR1 P21453 1/20 0.36
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HSD11B1 P28845 1/20 0.33

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
SCHEMBL7732669 0.96 RARB (0.38) RARBRARARARGKIF11S1PR1
SCHEMBL12623708 0.95 RARB (0.47) RARBRARARARGKIF11S1PR1
SCHEMBL12622965 0.94 RARB (0.43) RARBRARARARGKIF11S1PR1
SCHEMBL14226660 0.92 RARB (0.39) RARBRARARARGKIF11S1PR1
SCHEMBL7722731 0.92 RARB (0.41) RARBRARARARGKIF11S1PR1
SCHEMBL7732570 0.92 KIF11 (0.39) RARBRARARARGKIF11RAB9A
SCHEMBL12623705 0.92 RARB (0.40) RARBRARARARGKIF11S1PR1
SCHEMBL12624046 0.92 RARB (0.43) RARBRARARARGKIF11S1PR1
SCHEMBL12622961 0.92 RARB (0.40) RARBRARARARGKIF11S1PR1
SCHEMBL12623715 0.91 RARB (0.44) RARBRARARARGKIF11S1PR1

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
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed