SCHEMBL31684154

SCHEMBL31684154

CCC(CC)COC(=O)C1(NP(=O)(OC[C@H]2O[C@@](C#N)(c3ccc4c(N)ncnn34)[C@H](O)[C@@H]2O)Oc2ccccc2)CCC1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.38

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
SCHEMBL31684173 1.00 TMPRSS2 (0.38) TMPRSS2
SCHEMBL30939804 1.00 TMPRSS2 (0.38) TMPRSS2
SCHEMBL31684122 0.89 TMPRSS2 (0.30) TMPRSS2
SCHEMBL31684215 0.89 TMPRSS2 (0.30) TMPRSS2
SCHEMBL31684147 0.89 TMPRSS2 (0.30) TMPRSS2
SCHEMBL31684077 0.88 TMPRSS2 (0.38) TMPRSS2
SCHEMBL23960117 0.88 TMPRSS2 (0.41) TMPRSS2
Remdesivir SCHEMBL24494885 0.87 TMPRSS2 (0.40) TMPRSS2
Remdesivir SCHEMBL22143154 0.87 TMPRSS2 (0.40) TMPRSS2
Remdesivir SCHEMBL24611640 0.87 TMPRSS2 (0.40) 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
EP-4617278-A1 NUCLEOTIDE ANALOG, AND COMPOSITION AND USE THEREOF Shenzhen TargetRx, Inc. (CN) 2025-09-17 — — EP disclosed
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