SCHEMBL9925815

SCHEMBL9925815

CC(=O)NCSC(C)(C)CC(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)NCc1c[nH]nn1)C3

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GZMB P10144 20/20 0.51

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
SCHEMBL22697192 0.88 GZMB (0.56) GZMB
SCHEMBL22697125 0.87 GZMB (0.59) GZMB
SCHEMBL21186375 0.84 GZMB (0.54) GZMB
SCHEMBL26167009 0.84 GZMB (0.53) GZMB
SCHEMBL21186314 0.82 GZMB (0.53) GZMB
SCHEMBL9904628 0.82 GZMB (0.53) GZMB
SCHEMBL26418868 0.81 GZMB (0.56) GZMB
SCHEMBL22697083 0.81 GZMB (0.65) GZMB
SCHEMBL21186420 0.81 GZMB (0.56) GZMB
SCHEMBL22697180 0.80 GZMB (0.77) GZMB

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-2012076985-A2 GRANZYME B INHIBITOR COMPOSITIONS, METHODS AND USES FOR PROMOTING WOUND HEALING THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-06-14 WO disclosed