SCHEMBL31757477

SCHEMBL31757477

CC(C)(C)OC(=O)N[C@@H](Cc1ncccc1C#N)C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.48
▸ CTSS P25774 18/20 0.47
▸ CTSK P43235 16/20 0.47
▸ CTSB P07858 4/20 0.47
▸ CTSL P07711 2/20 0.47

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
SCHEMBL29529133 0.91 CTSS (0.47) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL21639182 0.91 PTPN1 (0.57) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL21639185 0.91 PTPN1 (0.57) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL29529315 0.85 MDM4 (0.46) PTPN1
SCHEMBL29529129 0.83 CTSS (0.50) CTSSCTSKCTSBCTSL
SCHEMBL29530113 0.79 CTSS (0.45) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL14280757 0.78 KLK5 (0.46) CTSSCTSKCTSBCTSL
SCHEMBL29529188 0.76 CTSS (0.44) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL29529243 0.76 CTSS (0.43) PTPN1CTSSCTSKCTSBCTSL
SCHEMBL29528935 0.75 CTSS (0.50) PTPN1CTSSCTSKCTSBCTSL

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-3604326-B1 PEPTIDE COMPOUND AND METHOD FOR PRODUCING SAME, COMPOSITION FOR SCREENING USE, AND METHOD FOR SELECTING PEPTIDE COMPOUND FUJIFILM CORP (JP) 2026-01-07 — — EP disclosed
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