SCHEMBL19865176

SCHEMBL19865176

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

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 19/20 0.59
▸ VEGFA P15692 7/20 0.57

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
SCHEMBL19865466 0.90 EPAS1 (0.52) EPAS1VEGFA
SCHEMBL19865425 0.88 EPAS1 (0.65) EPAS1VEGFA
SCHEMBL19865265 0.86 EPAS1 (0.60) EPAS1VEGFA
SCHEMBL19865245 0.84 VEGFA (0.54) EPAS1VEGFA
SCHEMBL16555658 0.82 EPAS1 (0.71) EPAS1VEGFA
SCHEMBL19865424 0.80 VEGFA (0.52) EPAS1VEGFA
SCHEMBL19865303 0.79 EPAS1 (0.70) EPAS1VEGFA
SCHEMBL19865177 0.79 EPAS1 (0.70) EPAS1VEGFA
SCHEMBL19865455 0.79 EPAS1 (0.63) EPAS1VEGFA
SCHEMBL16555532 0.77 EPAS1 (0.74) EPAS1VEGFA

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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