SCHEMBL9925798

SCHEMBL9925798

CC(=O)N[C@H](C(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)NCC1=CNNN1)C3)C1CC1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GZMB P10144 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
SCHEMBL9925818 0.87 GZMB (0.73) GZMB
SCHEMBL9904909 0.84 GZMB (0.77) GZMB
SCHEMBL21274622 0.82 ACE (0.71) GZMB
SCHEMBL9905289 0.81 GZMB (0.77) GZMB
SCHEMBL22697269 0.81 GZMB (0.77) GZMB
SCHEMBL22697253 0.80 GZMB (0.78) GZMB
SCHEMBL22687300 0.79 ACE (0.68) GZMB
SCHEMBL22687041 0.79 ACE (0.68) GZMB
SCHEMBL22687106 0.78 GZMB (0.68) GZMB
SCHEMBL9925685 0.77 GZMB (0.78) 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