SCHEMBL22203374

SCHEMBL22203374

CNC(O)c1nnc(CCC(F)Cn2cc(C(=O)NCc3cc(OC(F)(F)F)ccc3F)nn2)s1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.70

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
SCHEMBL21907772 0.89 GLS (0.73) GLS
SCHEMBL29753256 0.88 GLS (0.77) GLS
SCHEMBL17419978 0.88 GLS (0.77) GLS
SCHEMBL22203593 0.88 GLS (0.75) GLS
SCHEMBL29752733 0.87 GLS (0.77) GLS
SCHEMBL17420020 0.87 GLS (0.77) GLS
SCHEMBL17419857 0.83 GLS (1.00) GLS
SCHEMBL17412044 0.83 GLS (1.00) GLS
SCHEMBL29752986 0.83 GLS (1.00) GLS
SCHEMBL29753079 0.83 GLS (1.00) 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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