SCHEMBL21907452

SCHEMBL21907452

CNC(=O)c1cn(CCC(F)CN2C=C(C(=O)NCc3ccc(C(F)(F)F)cn3)NN2)nn1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.78

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
SCHEMBL17411884 0.88 GLS (1.00) GLS
SCHEMBL21907722 0.86 GLS (0.77) GLS
SCHEMBL22203476 0.84 GLS (0.66) GLS
SCHEMBL21907449 0.83 GLS (0.74) GLS
SCHEMBL22203514 0.78 GLS (0.81) GLS
SCHEMBL17411861 0.78 GLS (0.58) GLS
SCHEMBL17412045 0.78 GLS (0.81) GLS
SCHEMBL22203669 0.78 GLS (0.73) GLS
SCHEMBL22203491 0.78 GLS (1.00) GLS
SCHEMBL17411729 0.78 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-3164394-B1 GLS1 INHIBITORS FOR TREATING DISEASES UNIV TEXAS (US) 2020-04-01 — — EP disclosed
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