SCHEMBL24606239

SCHEMBL24606239

CCCC(=O)OC[C@H]1O[C@@](C#N)(c2cc(F)c3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.37
▸ ACVRL1 P37023 5/20 0.32
▸ PIK3CD O00329 6/20 0.32
▸ TNK2 Q07912 1/20 0.31

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
SCHEMBL24606246 0.94 TMPRSS2 (0.35) TMPRSS2ACVRL1PIK3CD
SCHEMBL24606242 0.93 TMPRSS2 (0.38) TMPRSS2ACVRL1PIK3CD
SCHEMBL24606241 0.90 TMPRSS2 (0.39) TMPRSS2ACVRL1PIK3CDTNK2
SCHEMBL24606244 0.89 TMPRSS2 (0.37) TMPRSS2ACVRL1PIK3CD
SCHEMBL24606248 0.88 TMPRSS2 (0.37) TMPRSS2ACVRL1PIK3CDTNK2
SCHEMBL24606253 0.88 TMPRSS2 (0.37) TMPRSS2ACVRL1PIK3CD
SCHEMBL23959977 0.88 TMPRSS2 (0.38) TMPRSS2ACVRL1PIK3CD
SCHEMBL24606249 0.87 TMPRSS2 (0.38) TMPRSS2ACVRL1PIK3CDTNK2
SCHEMBL23959985 0.86 TMPRSS2 (0.37) TMPRSS2ACVRL1PIK3CDTNK2
SCHEMBL24312585 0.85 TMPRSS2 (0.48) TMPRSS2

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-2022142477-A1 METHODS AND MODIFIED NUCLEOSIDES FOR TREATING CORONAVIRUS INFECTIONS SOUTHERN UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2022-07-07 — — WO disclosed
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