SCHEMBL19865245

SCHEMBL19865245

N#Cc1cc(F)cc(Oc2ccc(C(F)F)c3c2OC(F)(F)C3=O)c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 12/20 0.54
▸ EPAS1 Q99814 12/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46

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
SCHEMBL19865176 0.84 EPAS1 (0.59) VEGFAEPAS1
SCHEMBL19865424 0.83 VEGFA (0.52) VEGFAEPAS1
SCHEMBL19865425 0.82 EPAS1 (0.65) VEGFAEPAS1CYP2C9
SCHEMBL19865265 0.80 EPAS1 (0.60) VEGFAEPAS1
SCHEMBL19865225 0.76 VEGFA (0.54) VEGFAEPAS1CYP3A4CYP2C9
SCHEMBL19865223 0.76 VEGFA (0.54) VEGFAEPAS1CYP3A4CYP2C9
SCHEMBL19865336 0.76 VEGFA (0.43) VEGFAEPAS1
SCHEMBL21857881 0.72 VEGFA (0.67) VEGFAEPAS1CYP3A4CYP2C9
SCHEMBL19865466 0.72 EPAS1 (0.52) VEGFAEPAS1
SCHEMBL21857957 0.71 VEGFA (0.64) VEGFAEPAS1CYP3A4CYP2C9

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
WO-2018031680-A1 NOVEL COMPOUNDS, USES AND METHODS FOR THEIR PREPARATION FRONTHERA U.S. PHARMACEUTICALS LLC (US) 2018-02-15 — — WO disclosed
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