SCHEMBL30404662

SCHEMBL30404662

C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 14/20 0.48
▸ OPRK1 P41145 14/20 0.48
▸ EPHA2 P29317 2/20 0.43
▸ NRP1 O14786 1/20 0.42
▸ APLNR P35414 1/20 0.41

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
SCHEMBL20694557 0.93 OPRM1 (0.43) OPRM1OPRK1EPHA2NRP1
SCHEMBL22803172 0.91 OPRM1 (0.43) OPRM1OPRK1EPHA2NRP1
SCHEMBL29572497 0.90 OPRM1 (0.55) OPRM1OPRK1APLNR
SCHEMBL29571998 0.90 OPRM1 (0.48) OPRM1OPRK1EPHA2NRP1APLNR
SCHEMBL30416412 0.86 GRB2 (0.47) OPRM1OPRK1EPHA2NRP1
SCHEMBL29802094 0.86 OPRM1 (0.45) OPRM1OPRK1EPHA2NRP1
SCHEMBL22872708 0.85 NRP1 (0.54) OPRM1OPRK1EPHA2NRP1
SCHEMBL20694547 0.85 NRP1 (0.46) OPRM1OPRK1EPHA2NRP1
SCHEMBL35402417 0.85 OPRM1 (0.44) OPRM1OPRK1EPHA2
SCHEMBL29535207 0.84 OPRM1 (0.52) OPRM1OPRK1EPHA2NRP1APLNR

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-11685766-B2 14-3-3 targeting peptides for cancer treatment CREIGHTON UNIVERSITY (US) 2023-06-27 — — US disclosed
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