SCHEMBL30099417

SCHEMBL30099417

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 1/20 0.41
▸ APLNR P35414 1/20 0.41
▸ MMP3 P08254 5/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ NAA50 Q9GZZ1 1/20 0.38
▸ NTSR1 P30989 2/20 0.38
▸ MMP1 P03956 3/20 0.38
▸ CAPN1 P07384 2/20 0.37
▸ PSMB9 P28065 2/20 0.37
▸ NTSR2 O95665 1/20 0.37
▸ OPRD1 P41143 1/20 0.37

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
SCHEMBL30099452 0.95 KMT2A (0.40) RENAPLNRMMP3KMT2ANAA50
SCHEMBL29407478 0.94 REN (0.44) RENAPLNRMMP3KMT2ANAA50
SCHEMBL31670640 0.92 XIAP (0.38) RENAPLNRMMP3
SCHEMBL30483724 0.91 REN (0.44) RENAPLNRMMP3KMT2ANAA50
SCHEMBL30099624 0.90 REN (0.42) RENAPLNRMMP3KMT2ANAA50
SCHEMBL29945583 0.90 REN (0.42) RENAPLNRMMP3KMT2ANAA50
SCHEMBL29888963 0.90 MMP3 (0.44) RENAPLNRMMP3KMT2ANTSR1
SCHEMBL30933104 0.86 NAA50 (0.47) RENAPLNRMMP3NAA50NTSR1
SCHEMBL30468684 0.86 APLNR (0.43) RENAPLNRMMP3KMT2ANAA50
SCHEMBL31419720 0.86 APLNR (0.44) RENAPLNRMMP3KMT2ANAA50

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US claimed
WO-2023003984-A2 LABEL-FREE DETECTION OF PROTEASE ACTIVITY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-26 — — WO claimed
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US disclosed
WO-2023003984-A2 LABEL-FREE DETECTION OF PROTEASE ACTIVITY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-26 — — WO disclosed
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