SCHEMBL8472585

SCHEMBL8472585

CCCCCc1ccc(-c2c([O])cc(F)c(CCc3cc(F)c(C#N)c(F)c3)c2F)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.36
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GCGR P47871 1/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
GPR3 P46089 1/20 0.31
SPHK2 Q9NRA0 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
SCHEMBL8473428 0.97 RARB (0.33) RARB
SCHEMBL8473615 0.93 MEN1 (0.31)
SCHEMBL8475071 0.89 TRPV4 (0.31)
SCHEMBL8473301 0.89 RARB (0.40) RARBGCGRRARARARGGPR3
SCHEMBL8470570 0.88 TSHR (0.41) RARBTSHRHSD17B10RARARARG
SCHEMBL8472436 0.88 TSHR (0.32) RARBTSHRHSD17B10RARARARG
SCHEMBL8473838 0.86 RARB (0.36) RARBHSD17B10GCGRRARARARG
SCHEMBL8470743 0.85 TSHR (0.37) RARBTSHRHSD17B10RARARARG
SCHEMBL8474032 0.85 BCAT2 (0.33)
SCHEMBL8475369 0.84 RARB (0.37) RARBGCGRRARARARGGPR3

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-5858270-A Difluorooxymethane derivative and liquid crystal composition CHISSO CORPORATION (JP) 1999-01-12 US disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed