SCHEMBL9874783

SCHEMBL9874783

CCCCCCCCc1ccc(-c2ccc(OCCCCCC(C)CC)cc2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.46
RARB P10826 6/20 0.44
RARA P10276 2/20 0.44
SLC2A1 P11166 1/20 0.40
NR5A1 Q13285 1/20 0.40
RARG P13631 1/20 0.39
CNR1 P21554 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL9149632 0.87 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9752264 0.87 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9150071 0.87 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9399430 0.86 RARB (0.54) CNR2RARBRARANR5A1RARG
SCHEMBL9752262 0.85 RARB (0.55) RARBSLC2A1NR5A1CYP3A4CYP2D6
SCHEMBL9148458 0.85 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9150048 0.85 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9221987 0.85 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9230366 0.85 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4
SCHEMBL9148568 0.85 RARB (0.45) RARBRARASLC2A1NR5A1CYP3A4

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
JP-3176446-A None JP disclosed
JP-H03176446-A FLUORINE-CONTAINING BIPHENYL DERIVATIVE DAINIPPON INK & CHEM INC 1991-07-31 JP disclosed