SCHEMBL21702165

SCHEMBL21702165

CC(C)(C)NC(=O)C(=O)[C@H](C[C@@H]1CCCNC1=O)NC(=O)CN

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38

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
SCHEMBL21702235 0.93 CTSL (0.42) CTSLCTSB
SCHEMBL23506325 0.88 — —
SCHEMBL23506245 0.85 — —
SCHEMBL19605969 0.81 CTSB (0.38) CTSLCTSB
SCHEMBL23506336 0.81 CTSL (0.40) CTSLCTSB
SCHEMBL23506310 0.78 — —
SCHEMBL23506522 0.78 — —
SCHEMBL24112574 0.77 NOD1 (0.34) CTSLCTSB
SCHEMBL21702108 0.76 RAB9A (0.40) —
SCHEMBL24690561 0.74 — —

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-2020030143-A1 KETOAMIDE COMPOUND AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF 中国科学院上海药物研究所 2020-02-13 — — WO disclosed
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