SCHEMBL30819685

SCHEMBL30819685

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46

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
SCHEMBL24690562 0.93 CTSL (0.51) CTSLCTSB
SCHEMBL28732896 0.93 CTSL (0.51) CTSLCTSB
SCHEMBL24425333 0.93 CTSL (0.51) CTSLCTSB
SCHEMBL30819701 0.90 CTSL (0.44) CTSLCTSB
SCHEMBL24583074 0.88 REN (0.47) CTSLCTSB
SCHEMBL24691128 0.88 CTSS (0.46) CTSLCTSB
SCHEMBL30001761 0.88 CTSS (0.46) CTSLCTSB
SCHEMBL30819703 0.87 CTSL (0.60) CTSLCTSB
SCHEMBL19586868 0.85 CTSL (0.54) CTSLCTSB
SCHEMBL19586866 0.85 CTSL (0.54) CTSLCTSB

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
Send feedback