SCHEMBL31480032

SCHEMBL31480032

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 2/20 0.56
▸ OPRM1 P35372 6/20 0.55
▸ OPRD1 P41143 6/20 0.55
▸ OPRK1 P41145 4/20 0.55
▸ TFPI P10646 1/20 0.55
▸ NPBWR1 P48145 5/20 0.54

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
SCHEMBL29489260 0.89 OPRD1 (0.62) OPRM1OPRD1OPRK1TFPINPBWR1
SCHEMBL31480024 0.89 OPRL1 (0.63) OPRL1OPRM1OPRD1OPRK1TFPI
SCHEMBL30553752 0.89 TFPI (0.53) OPRL1OPRM1OPRD1OPRK1TFPI
SCHEMBL30662329 0.89 TFPI (0.61) OPRL1OPRM1OPRD1OPRK1TFPI
SCHEMBL29569118 0.88 OPRK1 (0.54) OPRM1OPRD1OPRK1
SCHEMBL30397713 0.88 OPRM1 (0.53) OPRM1OPRD1OPRK1
SCHEMBL29525489 0.87 TFPI (0.63) OPRM1OPRD1OPRK1TFPINPBWR1
SCHEMBL31433318 0.87 OPRD1 (0.58) OPRM1OPRD1OPRK1
SCHEMBL29733684 0.86 TFPI (0.60) OPRL1OPRM1OPRD1OPRK1TFPI
SCHEMBL31256987 0.86 OPRD1 (0.61) OPRM1OPRD1OPRK1NPBWR1

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
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US disclosed
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