SCHEMBL30198370

SCHEMBL30198370

CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](CO)NC(=O)CNC(=O)CNC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)CC

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.56
▸ NTSR1 P30989 2/20 0.56
▸ NTSR2 O95665 1/20 0.54
▸ NMUR2 Q9GZQ4 3/20 0.53
▸ NMUR1 Q9HB89 3/20 0.53
▸ OPRM1 P35372 1/20 0.53

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
SCHEMBL30198135 0.92 NTSR1 (0.55) OPRD1NTSR1NTSR2NMUR2NMUR1
SCHEMBL30835500 0.91 NTSR1 (0.55) OPRD1NTSR1NTSR2NMUR2NMUR1
SCHEMBL31670643 0.84 OPRD1 (0.59) OPRD1NTSR1NTSR2OPRM1
SCHEMBL30198139 0.83 NPY1R (0.55) OPRD1NTSR1NTSR2OPRM1
SCHEMBL30633111 0.82 NTSR1 (0.56) OPRD1NTSR1NTSR2NMUR2NMUR1
SCHEMBL31461843 0.81 OPRD1 (0.54) OPRD1NTSR1OPRM1
SCHEMBL31462040 0.81 CALCR (0.54) OPRD1
SCHEMBL29510563 0.81 NTSR2 (0.58) NTSR1NTSR2
SCHEMBL30835501 0.81 NTSR1 (0.54) OPRD1NTSR1NTSR2OPRM1
SCHEMBL29467322 0.80 OPRD1 (0.56) OPRD1NTSR1NTSR2NMUR2NMUR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4362970-A1 MONOMERIC FUSION PEPTIDES AND METHOD OF USE THEREOF Allysta Pharmaceuticals, Inc. (US) 2024-05-08 — — EP disclosed
CN-117750969-A Monomeric fusion peptides and methods of use thereof 雅利斯塔制药公司 2024-03-22 — — CN disclosed
US-20230021946-A1 MONOMERIC FUSION PEPTIDES AND METHOD OF USE THEREOF ALLYSTA PHARMACEUTICALS, INC. 2023-01-26 — — US disclosed
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