SCHEMBL30198135

SCHEMBL30198135

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

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 2/20 0.55
▸ OPRD1 P41143 6/20 0.55
▸ NMUR2 Q9GZQ4 5/20 0.53
▸ NMUR1 Q9HB89 5/20 0.53
▸ NTSR2 O95665 1/20 0.53
▸ CALCR P30988 1/20 0.51

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
SCHEMBL30835500 0.99 NTSR1 (0.55) NTSR1OPRD1NMUR2NMUR1NTSR2
SCHEMBL30198139 0.92 NPY1R (0.55) NTSR1OPRD1NTSR2
SCHEMBL30198370 0.92 OPRD1 (0.56) NTSR1OPRD1NMUR2NMUR1NTSR2
SCHEMBL30198138 0.86 NPY1R (0.60) NTSR1NTSR2
SCHEMBL29467322 0.80 OPRD1 (0.56) NTSR1OPRD1NMUR2NMUR1NTSR2
SCHEMBL29510563 0.80 NTSR2 (0.58) NTSR1NTSR2
SCHEMBL31461843 0.79 OPRD1 (0.54) NTSR1OPRD1
SCHEMBL30633111 0.79 NTSR1 (0.56) NTSR1OPRD1NMUR2NMUR1NTSR2
SCHEMBL30571162 0.79 F2 (0.61) NTSR1NMUR2NMUR1NTSR2CALCR
SCHEMBL30504141 0.78 NTSR1 (0.57) NTSR1OPRD1NTSR2

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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