SCHEMBL7733508

SCHEMBL7733508

CCCCCc1ccc(C(F)(F)Oc2ccc(-c3cc(F)c(OC(F)(F)F)c(F)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.44
RARA P10276 2/20 0.44
RARG P13631 1/20 0.44
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
MTOR P42345 1/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL7731928 0.97 RARB (0.39) RARBRARARARGPPARGPPARA
SCHEMBL12624839 0.94 RARB (0.44) RARBRARARARGCASP3SENP8
SCHEMBL7734772 0.92 HTR2A (0.37) RARBRARARARGHSD17B10MEN1
SCHEMBL7730636 0.92 MAOB (0.35) RARBRARARARGTSHRPPARG
SCHEMBL12623053 0.92 RARB (0.42) RARBRARARARGCASP3SENP8
SCHEMBL12624827 0.91 RARB (0.44) RARBRARARARGCASP3SENP8
SCHEMBL7732528 0.91 HTR2A (0.36) RARBRARARARGMEN1ALDH1A1
SCHEMBL7729958 0.89 HTR2A (0.39) RARBRARARARGHSD17B10ALDH1A1
SCHEMBL12623055 0.89 RARB (0.43) RARBRARARARGCASP3SENP8
SCHEMBL12624830 0.89 RARB (0.43) RARBRARARARGCASP3SENP8

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