SCHEMBL29649733

SCHEMBL29649733

N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 12/20 0.49
▸ OPRM1 P35372 11/20 0.49
▸ OPRK1 P41145 4/20 0.44
▸ QRFPR Q96P65 1/20 0.42

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
SCHEMBL30974516 0.92 OPRD1 (0.53) OPRD1OPRM1OPRK1
SCHEMBL30692725 0.92 OPRD1 (0.52) OPRD1OPRM1OPRK1
SCHEMBL29630465 0.92 OPRD1 (0.38) OPRD1OPRM1OPRK1
SCHEMBL29630518 0.91 OPRD1 (0.37) OPRD1OPRM1OPRK1
SCHEMBL29398077 0.90 CCKAR (0.47) OPRD1OPRM1
SCHEMBL30974011 0.90 OPRD1 (0.49) OPRD1OPRM1OPRK1
SCHEMBL29630685 0.89 OPRD1 (0.38) OPRD1OPRM1OPRK1
SCHEMBL30712882 0.88 OPRM1 (0.59) OPRD1OPRM1OPRK1
SCHEMBL30974165 0.87 OPRD1 (0.47) OPRD1OPRM1OPRK1
SCHEMBL30659881 0.86 OPRD1 (0.48) OPRD1OPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112190687-B Medicine for reducing skin wound scar and application thereof 温州医科大学附属第一医院 2022-06-10 — — CN disclosed
CN-112190687-B Medicine for reducing skin wound scar and application thereof 温州医科大学附属第一医院 2022-06-10 — — CN disclosed
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