SCHEMBL22203593

SCHEMBL22203593

CNC(O)c1nnc(CCC(F)Cn2cc(C(=O)NCc3cccc(OC(F)(F)F)c3)nn2)s1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.75

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
SCHEMBL21908340 0.89 GLS (0.81) GLS
SCHEMBL29753240 0.88 GLS (0.85) GLS
SCHEMBL17411757 0.88 GLS (0.85) GLS
SCHEMBL22203374 0.88 GLS (0.70) GLS
SCHEMBL17419667 0.87 GLS (0.84) GLS
SCHEMBL29752693 0.87 GLS (0.84) GLS
SCHEMBL17411962 0.86 GLS (0.76) GLS
SCHEMBL29753147 0.86 GLS (0.85) GLS
SCHEMBL17419692 0.86 GLS (0.85) GLS
SCHEMBL29752932 0.86 GLS (0.76) GLS

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-3677579-A1 HETEROCYCLIC GLS1 INHIBITORS Board of Regents, The University of Texas System (US) 2020-07-08 — — EP disclosed
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