SCHEMBL31757463

SCHEMBL31757463

Cc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cnc1C#N

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 14/20 0.46
▸ CTSK P43235 12/20 0.46
▸ CTSB P07858 4/20 0.46
▸ CTSL P07711 2/20 0.46
▸ SYK P43405 1/20 0.43
▸ KLK5 Q9Y337 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ ACE P12821 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL29528993 0.92 CTSS (0.45) CTSSCTSKCTSBCTSLSYK
SCHEMBL21639428 0.91 ACE (0.49) CTSSCTSKCTSBCTSLSYK
SCHEMBL21639430 0.91 ACE (0.49) CTSSCTSKCTSBCTSLSYK
SCHEMBL31757459 0.88 CTSS (0.47) CTSSCTSKCTSBCTSLSYK
SCHEMBL31757443 0.87 CTSS (0.47) CTSSCTSKCTSBCTSLSYK
SCHEMBL29528935 0.85 CTSS (0.50) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL29529093 0.84 MDM4 (0.43) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL29529364 0.81 CTSS (0.47) CTSSCTSKCTSBCTSLSYK
SCHEMBL25657795 0.80 CTSS (0.51) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL29529216 0.80 CTSS (0.46) CTSSCTSKCTSBCTSLSYK

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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