SCHEMBL13769846

SCHEMBL13769846

CSCC[C@H](NC(=O)C(CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)C(NC(=O)C(C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(N)=O)NC(=O)CC[C@@H](C)C1CCC2C3CCC4CC(NC(=O)CNC(=O)CNCCNCC(=O)O)CCC4(C)C3CC(=O)C21C)C(C)C)C(N)=O

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRPR P30550 17/20 0.80

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
SCHEMBL1251420 0.94 GRPR (0.89) GRPR
SCHEMBL16317504 0.94 GRPR (0.89) GRPR
SCHEMBL1526993 0.94 GRPR (0.89) GRPR
SCHEMBL1251393 0.94 GRPR (0.89) GRPR
SCHEMBL13770333 0.92 GRPR (0.70) GRPR
SCHEMBL12419854 0.92 GRPR (0.84) GRPR
SCHEMBL1356632 0.92 GRPR (0.84) GRPR
SCHEMBL1356610 0.92 GRPR (0.84) GRPR
SCHEMBL16301384 0.90 GRPR (0.81) GRPR
SCHEMBL1413930 0.90 GRPR (0.80) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583564-B1 IMPROVED LINKERS FOR RADIOPHARMACEUTICAL COMPOUNDS BRACCO IMAGING SPA (IT) 2009-07-01 — — EP disclosed
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