SCHEMBL23506388

SCHEMBL23506388

CNCC(=O)NC(CC1CCCNC1=O)C(=O)C(=O)NC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ CTSK P43235 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.37
▸ CCR2 P41597 1/20 0.35
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL23506243 0.88 LMNA (0.46) CTSLCTSBCTSKNOD1
SCHEMBL23506235 0.88 LMNA (0.46) CTSLCTSBCTSKNOD1
SCHEMBL23506325 0.85 — —
SCHEMBL23506247 0.82 LMNA (0.47) CTSLCTSB
SCHEMBL23506278 0.82 LMNA (0.47) CTSLCTSB
SCHEMBL23506361 0.81 MMP13 (0.37) CTSLCTSBKMT2A
SCHEMBL19606056 0.80 CTSB (0.39) CTSLCTSB
SCHEMBL23506441 0.79 CTSL (0.48) CTSLCTSB
SCHEMBL23506336 0.78 CTSL (0.40) CTSLCTSB
SCHEMBL21702238 0.78 CCKBR (0.41) —

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
EP-3835296-A1 KETOAMIDE COMPOUND AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2021-06-16 — — EP disclosed
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