SCHEMBL30973754

SCHEMBL30973754

COC(C)(C)C(=O)O[C@H]1[C@@H](O)[C@](C#N)(c2ccc3c(NC(=O)c4ccccc4)ncnn23)O[C@@H]1CO

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.58
▸ EGLN2 Q96KS0 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
SCHEMBL24917569 0.90 TMPRSS2 (0.63) TMPRSS2EGLN2
SCHEMBL26136380 0.90 TMPRSS2 (0.63) TMPRSS2EGLN2
SCHEMBL24791240 0.88 TMPRSS2 (0.61) TMPRSS2EGLN2
SCHEMBL24917209 0.88 TMPRSS2 (0.60) TMPRSS2EGLN2
SCHEMBL26136509 0.88 TMPRSS2 (0.60) TMPRSS2EGLN2
SCHEMBL24789444 0.87 TMPRSS2 (0.58) TMPRSS2EGLN2
SCHEMBL30973751 0.86 TMPRSS2 (0.49) TMPRSS2
SCHEMBL30973752 0.86 TMPRSS2 (0.59) TMPRSS2EGLN2
SCHEMBL24917096 0.86 TMPRSS2 (0.59) TMPRSS2EGLN2
SCHEMBL25909937 0.86 TMPRSS2 (0.59) TMPRSS2EGLN2

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-2024129963-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. (US) 2024-06-20 — — WO disclosed
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