SCHEMBL30819664

SCHEMBL30819664

CC(C)(C)[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.57
CTSB P07858 1/20 0.57
CTSS P25774 1/20 0.57

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
SCHEMBL25779449 0.89 CTSL (0.61) CTSLCTSBCTSS
SCHEMBL28732952 0.89
SCHEMBL24960974 0.86 CTSL (0.62) CTSLCTSBCTSS
SCHEMBL30819697 0.86 CTSL (0.75) CTSLCTSBCTSS
SCHEMBL24256979 0.86 CTSL (0.75) CTSLCTSBCTSS
SCHEMBL25809322 0.86 CTSL (0.75) CTSLCTSBCTSS
SCHEMBL24257148 0.86 CTSL (0.77) CTSLCTSBCTSS
SCHEMBL24690534 0.86 CTSB (0.57) CTSLCTSBCTSS
SCHEMBL30887835 0.86 CTSL (0.61) CTSLCTSBCTSS
SCHEMBL24960971 0.86 CTSL (0.61) CTSLCTSBCTSS

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-2024086777-A2 COMPOUNDS AND METHODS FOR TREATING DISEASES CAUSED BY VIRUSES AND BACTERIA THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-04-25 WO disclosed