SCHEMBL8836799

SCHEMBL8836799

CCCCCCCc1ccc(-c2c([O])cc(F)c(CCc3cc(F)c(F)c(F)c3)c2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.45
RARA P10276 2/20 0.45
RARG P13631 1/20 0.45
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
MTOR P42345 1/20 0.39
HTR2A P28223 1/20 0.39
HSD17B10 Q99714 3/20 0.37
TSHR P16473 1/20 0.37
ESR1 P03372 2/20 0.36
ADRA2A P08913 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
TACR2 P21452 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL8836463 1.00 RARB (0.45) RARBRARARARGALDH1A1MEN1
SCHEMBL8836851 1.00 RARB (0.45) RARBRARARARGALDH1A1MEN1
SCHEMBL8836062 1.00 RARB (0.45) RARBRARARARGALDH1A1MEN1
SCHEMBL8836400 1.00 RARB (0.45) RARBRARARARGALDH1A1MEN1
SCHEMBL8836568 0.99 RARB (0.43) RARBRARARARGALDH1A1MEN1
SCHEMBL8836795 0.95 RARB (0.39) RARBRARARARGALDH1A1MEN1
SCHEMBL8474034 0.90 RARB (0.33) RARBRARARARGALDH1A1MEN1
SCHEMBL8836753 0.89 RARB (0.40) RARBRARARARGALDH1A1MEN1
SCHEMBL8470570 0.88 TSHR (0.41) RARBRARARARGALDH1A1MEN1
SCHEMBL8836445 0.86 FFAR4 (0.34) GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed