SCHEMBL29780239

SCHEMBL29780239

CS(=O)(=O)c1ccc(Nc2cc(F)cc(C#N)c2)c2cn[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 20/20 0.41
▸ VEGFA P15692 3/20 0.37

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
SCHEMBL23461066 1.00 EPAS1 (0.41) EPAS1VEGFA
SCHEMBL23461602 0.88 EPAS1 (0.42) EPAS1VEGFA
SCHEMBL29780196 0.88 EPAS1 (0.42) EPAS1VEGFA
SCHEMBL29780225 0.81 EPAS1 (0.39) EPAS1VEGFA
SCHEMBL23461012 0.81 EPAS1 (0.39) EPAS1VEGFA
SCHEMBL23461094 0.80 IDH1 (0.37) —
SCHEMBL29780205 0.80 IDH1 (0.37) —
SCHEMBL23461045 0.78 EPAS1 (0.62) EPAS1VEGFA
SCHEMBL29780177 0.78 EPAS1 (0.62) EPAS1VEGFA
SCHEMBL23478125 0.76 EPAS1 (0.39) 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
CN-114760994-A Inhibitors of HIF-2 alpha 艾库斯生物科学有限公司 2022-07-15 — — CN disclosed
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