SCHEMBL30999560

SCHEMBL30999560

CSCC[C@H](NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CBr)C(N)=O

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 10/20 0.66
▸ CCKAR P32238 2/20 0.65

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
Tetragastrin SCHEMBL30999571 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL30999635 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL30999517 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL9710792 0.94 CCKBR (0.70) CCKBRCCKAR
SCHEMBL18054010 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL31332160 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL9710788 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL30999542 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL30999572 0.94 CCKBR (0.70) CCKBRCCKAR
Tetragastrin SCHEMBL11568902 0.94 CCKBR (0.70) CCKBRCCKAR

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
EP-4421082-A1 POLYPEPTIDE AND APPLICATION THEREOF AS CCK RECEPTOR AGONIST/ANTAGONIST Centre for Regenerative Medicine and Health, Hong Kong Institute of Science & Innovation, Chinese Academy of Sciences Limited (HK) 2024-08-28 — — EP disclosed
Send feedback