SCHEMBL7735394

SCHEMBL7735394

CCCCCc1cc(F)c(C(F)(F)Oc2ccc(-c3cc(F)c(C#N)c(F)c3)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RARB P10826 4/20 0.37
RARA P10276 2/20 0.37
RARG P13631 1/20 0.37
GRM2 Q14416 2/20 0.33
MAPT P10636 4/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
MGAT2 Q10469 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
PPARG P37231 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
SCHEMBL7730485 0.97 TSHR (0.35) TSHRHSD17B10RARBRARARARG
SCHEMBL7722816 0.92 CTSS (0.33) RARBRARAGRM2MAPTKDM4E
SCHEMBL7722550 0.91 HSD17B10 (0.39) TSHRHSD17B10RARBRARARARG
SCHEMBL12623879 0.90 RARB (0.41) TSHRHSD17B10RARBRARARARG
SCHEMBL12624900 0.90 RARB (0.41) TSHRHSD17B10RARBRARARARG
SCHEMBL7722828 0.89 RARB (0.41) TSHRHSD17B10RARBRARARARG
SCHEMBL7729908 0.88 TSHR (0.32) TSHRHSD17B10S1PR1THRB
SCHEMBL12624892 0.88 RARB (0.41) TSHRHSD17B10RARBRARARARG
SCHEMBL12623880 0.88 RARB (0.43) TSHRHSD17B10RARBRARARARG
SCHEMBL7735399 0.88 TSHR (0.34) TSHRHSD17B10RARBRARARARG

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