SCHEMBL1413932

SCHEMBL1413932

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)C(N)CC(N)=O)C(C)C)C(N)=O

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRPR P30550 15/20 0.68

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
SCHEMBL1413933 1.00 GRPR (0.68) GRPR
SCHEMBL5350846 0.97 GRPR (0.66) GRPR
SCHEMBL4352522 0.96 GRPR (0.67) GRPR
SCHEMBL4352525 0.96 GRPR (0.67) GRPR
SCHEMBL19102240 0.93 GRPR (0.69) GRPR
SCHEMBL16508339 0.93 GRPR (0.69) GRPR
SCHEMBL4353652 0.93 GRPR (0.62) GRPR
SCHEMBL4353658 0.93 GRPR (0.62) GRPR
SCHEMBL4344249 0.92 GRPR (0.69) GRPR
SCHEMBL31738530 0.92 GRPR (0.64) GRPR

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
EP-2291075-A2 GASTRIN RELEASING PEPTIDE COMPOUNDS Bracco Imaging S.p.A (IT) 2011-03-09 — — EP disclosed
WO-2009143101-A2 GASTRIN RELEASING PEPTIDE COMPOUNDS BRACCO IMAGING S.P.A. (IT) 2009-11-26 — — WO disclosed
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