SCHEMBL25009374

SCHEMBL25009374

NC(=O)Nc1ncnn2c([C@H]3CC[C@@H](COC(=O)S)O3)ccc12

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 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
SCHEMBL24982214 0.91 PDE2A (0.31) —
SCHEMBL26200336 0.83 PDE2A (0.31) —
SCHEMBL24606323 0.80 TSHR (0.32) —
SCHEMBL26200344 0.79 TSHR (0.34) —
SCHEMBL24606310 0.75 DOT1L (0.36) —
SCHEMBL24791279 0.75 L3MBTL1 (0.34) —
SCHEMBL24606327 0.75 DOT1L (0.34) —
SCHEMBL24606262 0.74 DOT1L (0.36) —
SCHEMBL24606280 0.74 DOT1L (0.35) —
SCHEMBL26027103 0.74 DOT1L (0.36) —

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-2023011994-A1 PROCESS FOR THE CATALYTIC GLYCOSYLATION OF ARENES STUDIENGESELLSCHAFT KOHLE MBH (DE) 2023-02-09 — — WO disclosed
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