SCHEMBL1618505

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(CCC(N)=O)NC(=O)c1ccc(NC(=O)CNC(=O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)cc1)C(C)C)C(N)=O

nearest known ligand 0.92

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	GRPR	P30550	19/20	0.92

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.

Compound	similarity	top predicted	shared targets
SCHEMBL1252416	1.00	GRPR (0.92)	GRPR
SCHEMBL16301404	1.00	GRPR (0.92)	GRPR
SCHEMBL16301389	0.98	GRPR (0.96)	GRPR
SCHEMBL16301406	0.98	GRPR (0.89)	GRPR
SCHEMBL16301399	0.98	GRPR (0.88)	GRPR
SCHEMBL16301391	0.98	GRPR (0.88)	GRPR
SCHEMBL14959345	0.97	GRPR (0.87)	GRPR
SCHEMBL16301400	0.97	GRPR (0.87)	GRPR
SCHEMBL1251823	0.97	GRPR (0.87)	GRPR
SCHEMBL16301381	0.96	GRPR (0.86)	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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-7922998-B2	bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy	BRACCO IMAGING S.P.A. (IT)	2011-04-12	—	—	US	disclosed