SCHEMBL24790934

SCHEMBL24790934

CCC(=O)OC[C@H]1O[C@@](C)(c2ccc3c(N)ncnn23)C[C@@H]1OC(=O)CC

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.30
▸ CA12 O43570 2/20 0.30
▸ CA1 P00915 2/20 0.30
▸ CA2 P00918 2/20 0.30
▸ CA9 Q16790 2/20 0.30
▸ CA14 Q9ULX7 2/20 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
SCHEMBL24791276 0.91 — —
SCHEMBL24791277 0.89 POLRMT (0.32) RIPK1
SCHEMBL24790430 0.86 RIPK1 (0.32) RIPK1
SCHEMBL24312581 0.83 CA12 (0.33) RIPK1CA12CA1CA2CA9
SCHEMBL24917062 0.81 POLRMT (0.34) RIPK1
SCHEMBL24790485 0.80 PIK3CD (0.35) RIPK1
SCHEMBL24790936 0.80 LMNA (0.31) —
SCHEMBL24791782 0.78 RIPK1 (0.31) RIPK1
SCHEMBL25916692 0.78 TMPRSS2 (0.33) CA12CA1CA2CA9CA14
SCHEMBL24917064 0.78 PIK3CD (0.32) —

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-2022265964-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. (US) 2022-12-22 — — WO disclosed
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