SCHEMBL31480024

SCHEMBL31480024

C[C@H](NC(=O)[C@H](C)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](CC(N)=O)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)O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 7/20 0.63
▸ TFPI P10646 1/20 0.56
▸ OPRM1 P35372 4/20 0.54
▸ OPRD1 P41143 4/20 0.54
▸ OPRK1 P41145 4/20 0.54
▸ BACE1 P56817 1/20 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
SCHEMBL30662329 0.93 TFPI (0.61) OPRL1TFPIOPRM1OPRD1OPRK1
SCHEMBL30900788 0.91 OPRD1 (0.60) OPRL1TFPIOPRM1OPRD1OPRK1
SCHEMBL30512642 0.90 BACE1 (0.57) OPRL1TFPIBACE1
SCHEMBL31480032 0.89 OPRL1 (0.56) OPRL1TFPIOPRM1OPRD1OPRK1
SCHEMBL30099625 0.89 BACE1 (0.62) OPRL1BACE1
SCHEMBL10746970 0.89 OPRL1 (0.59) OPRL1TFPIBACE1
SCHEMBL10747004 0.89 OPRL1 (0.59) OPRL1TFPIBACE1
SCHEMBL4399655 0.89 OPRL1 (0.54) OPRL1TFPIOPRM1OPRD1
SCHEMBL4399651 0.89 OPRL1 (0.54) OPRL1TFPIOPRM1OPRD1
SCHEMBL31598488 0.89 CCKBR (0.53) OPRL1OPRD1BACE1

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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