SCHEMBL9925685

SCHEMBL9925685

CC[C@H](C)[C@H](NC(=O)Cc1csc2ccccc12)C(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)NCC1=CNNN1)C3

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GZMB P10144 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
SCHEMBL15485596 0.87 GZMB (0.83) GZMB
SCHEMBL30431008 0.87 GZMB (0.83) GZMB
SCHEMBL22697207 0.87 GZMB (0.83) GZMB
SCHEMBL21186459 0.87 GZMB (0.83) GZMB
SCHEMBL25353501 0.87 GZMB (0.76) GZMB
SCHEMBL22687199 0.87 GZMB (0.76) GZMB
SCHEMBL9925820 0.87 GZMB (0.82) GZMB
SCHEMBL16081687 0.87 GZMB (0.82) GZMB
SCHEMBL9925818 0.86 GZMB (0.73) GZMB
SCHEMBL22697236 0.82 GZMB (0.80) 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