SCHEMBL25225235

SCHEMBL25225235

CC(C)(C)[Si](Nc1ncnn2c(C3(C#N)O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H]3OCc3ccccc3)ccc12)(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.35
▸ BCHE P06276 1/20 0.32

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
SCHEMBL25220161 0.88 BCHE (0.33) BCHE
SCHEMBL15084421 0.88 TMPRSS2 (0.39) TMPRSS2BCHE
SCHEMBL25273419 0.87 TMPRSS2 (0.36) TMPRSS2BCHE
SCHEMBL25211797 0.84 TMPRSS2 (0.37) TMPRSS2BCHE
SCHEMBL17712276 0.82 PDE2A (0.35) TMPRSS2BCHE
SCHEMBL20553048 0.82 PDE2A (0.35) TMPRSS2BCHE
SCHEMBL12243178 0.82 PDE2A (0.35) TMPRSS2BCHE
SCHEMBL25259971 0.82 BCHE (0.36) TMPRSS2BCHE
SCHEMBL20477154 0.82 PDE2A (0.35) TMPRSS2BCHE
SCHEMBL28408184 0.82 HTR1A (0.33) TMPRSS2BCHE

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-4192839-A1 REMDESIVIR INTERMEDIATES Richter Gedeon Nyrt. (HU) 2023-06-14 — — EP disclosed
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