SCHEMBL23378661

SCHEMBL23378661

N#Cc1cc(F)cc(Oc2cccc3c2[C@@H](F)[C@@H](F)[C@H]3O)c1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 15/20 0.61
▸ VEGFA P15692 9/20 0.61

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
SCHEMBL23378617 0.81 EPAS1 (0.72) EPAS1VEGFA
SCHEMBL31497898 0.80 VEGFA (0.45) EPAS1VEGFA
SCHEMBL31497947 0.80 VEGFA (0.45) EPAS1VEGFA
SCHEMBL28579740 0.80 EPAS1 (0.59) EPAS1VEGFA
SCHEMBL31135653 0.78 VEGFA (0.62) EPAS1VEGFA
SCHEMBL21902843 0.78 VEGFA (0.62) EPAS1VEGFA
SCHEMBL21005531 0.78 EPAS1 (0.68) EPAS1VEGFA
SCHEMBL21432429 0.78 EPAS1 (0.68) EPAS1VEGFA
SCHEMBL18688485 0.78 EPAS1 (0.68) EPAS1VEGFA
SCHEMBL30933846 0.77 EPAS1 (0.64) 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-2021093724-A1 NOVEL 2,3-HYDRINDENE DERIVATIVE COMPOUND, PREPARATION METHOD AND APPLICATION 武汉光谷亚太医药研究院有限公司 2021-05-20 — — WO disclosed
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