SCHEMBL23478766

SCHEMBL23478766

Fc1cc(Cl)cc(Nc2ccc(SC(F)(F)F)c3[nH]ncc23)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 11/20 0.39
▸ GRM4 Q14833 1/20 0.35
▸ ARNT P27540 1/20 0.35
▸ RAPGEF4 Q8WZA2 1/20 0.33
▸ TGFBR1 P36897 2/20 0.32
▸ BRAF P15056 1/20 0.31
▸ EIF2AK3 Q9NZJ5 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ MKNK1 Q9BUB5 1/20 0.31
▸ CCR2 P41597 1/20 0.30
▸ AURKA O14965 1/20 0.30

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
SCHEMBL29780231 0.78 EPAS1 (0.41) EPAS1
SCHEMBL23478762 0.78 EPAS1 (0.41) EPAS1
SCHEMBL29780217 0.69 EPAS1 (0.39) EPAS1MAPK1HTTMKNK1AURKA
SCHEMBL23478125 0.69 EPAS1 (0.39) EPAS1MAPK1HTTMKNK1AURKA
SCHEMBL23461094 0.67 IDH1 (0.37) AURKA
SCHEMBL29780205 0.67 IDH1 (0.37) AURKA
SCHEMBL23478387 0.65 LMNA (0.35) EPAS1HTT
SCHEMBL29780196 0.63 EPAS1 (0.42) EPAS1
SCHEMBL23461602 0.63 EPAS1 (0.42) EPAS1
SCHEMBL23462206 0.62 IDO1 (0.44) BRAFEIF2AK3

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-2021113436-A1 INHIBITORS OF HIF-2ALPHA ARCUS BIOSCIENCES, INC. (US) 2021-06-10 — — WO disclosed
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