SCHEMBL8472885

SCHEMBL8472885

CCCCCc1ccc(-c2c([O])cc(F)c(CCc3cc(F)c(OC(F)(F)F)c(F)c3)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.38
RARA P10276 2/20 0.38
RARG P13631 1/20 0.38
FFAR4 Q5NUL3 4/20 0.34
FAAH O00519 1/20 0.34
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MTOR P42345 1/20 0.32
KMT2A Q03164 1/20 0.32
HTR2A P28223 1/20 0.32
SPNS2 Q8IVW8 2/20 0.31
GPR84 Q9NQS5 1/20 0.31
S1PR1 P21453 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
SCHEMBL8471174 0.97 FFAR4 (0.35) RARBRARARARGFFAR4FAAH
SCHEMBL8472337 0.93 FFAR4 (0.36) FFAR4
SCHEMBL8470647 0.90 RARB (0.39) RARBRARARARGFFAR4FAAH
SCHEMBL8473305 0.89 PTGS2 (0.30)
SCHEMBL8473634 0.89 FFAR4 (0.40) FFAR4
SCHEMBL8476679 0.89 RARB (0.35) RARBRARARARGFAAHS1PR1
SCHEMBL8475372 0.89 RARB (0.37) RARBRARARARGFAAHS1PR1
SCHEMBL8836568 0.87 RARB (0.43) RARBRARARARGMEN1ALDH1A1
SCHEMBL8836817 0.86 DAO (0.37) RARBRARARARGFFAR4FAAH
SCHEMBL8836753 0.86 RARB (0.40) RARBRARARARGFFAR4FAAH

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