SCHEMBL27121333

SCHEMBL27121333

CN(C)C(=O)OC[C@@H]1CC[C@](C#N)(c2ccc3c(N)ncnn23)O1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.32
▸ PIK3CD O00329 5/20 0.31
▸ KCNH2 Q12809 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
SCHEMBL24789794 0.90 PIK3CD (0.34) TMPRSS2PIK3CD
SCHEMBL27121554 0.89 PIK3CD (0.31) PIK3CD
SCHEMBL29566128 0.89 TMPRSS2 (0.32) TMPRSS2PIK3CD
SCHEMBL24790497 0.89 PIK3CD (0.33) TMPRSS2PIK3CD
SCHEMBL26399140 0.86 PIK3CD (0.33) TMPRSS2PIK3CD
SCHEMBL24790990 0.86 TMPRSS2 (0.30) TMPRSS2PIK3CD
SCHEMBL26399178 0.85 TMPRSS2 (0.32) TMPRSS2PIK3CD
SCHEMBL26399191 0.85 AXL (0.32) TMPRSS2
SCHEMBL26399270 0.84 PIK3CD (0.32) PIK3CD
SCHEMBL26399290 0.84 PIK3CD (0.32) PIK3CD

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
EP-4328227-A1 NUCLEOSIDE COMPOUND AND APPLICATION THEREOF IN THE TREATMENT OF FELINE INFECTIOUS PERITONITIS Vigonvita Life Sciences Co., Ltd. (CN) 2024-02-28 — — EP disclosed
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