SCHEMBL18122467

SCHEMBL18122467

CNC(CCCCc1nnc(NC(=O)Cc2cccc(OCCO)c2)s1)SC(=N)NC(=O)Cc1cccc(OCCO)c1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 20/20 0.72

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
SCHEMBL14987642 0.84 GLS (1.00) GLS
SCHEMBL16305178 0.84 GLS (1.00) GLS
SCHEMBL15043731 0.78 GLS (1.00) GLS
SCHEMBL14987502 0.76 GLS (1.00) GLS
SCHEMBL14987128 0.76 GLS (1.00) GLS
SCHEMBL22623427 0.74 GLS (0.69) GLS
SCHEMBL14987164 0.74 GLS (1.00) GLS
SCHEMBL15727696 0.73 GLS (0.81) GLS
SCHEMBL15042469 0.73 GLS (1.00) GLS
SCHEMBL16379546 0.72 GLS (0.75) 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
WO-2016160980-A1 METHODS OF ADMINISTERING GLUTAMINASE INHIBITORS CALITHERA BIOSCIENCES, INC. (US) 2016-10-06 — — WO disclosed
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