SCHEMBL9544205

CC(C)(C)OC(=O)N1c2ccccc2C[C@@H]1C(=O)N1C[C@@H](Sc2ccccc2)C[C@@H]1C(=O)N1Cc2ccccc2C[C@@H]1CC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	ACE	P12821	1/20	0.35

▸	KMT2A	Q03164	1/20	0.35

▸	NPC1	O15118	1/20	0.34

▸	ALDH1A1	P00352	1/20	0.34

▸	NAMPT	P43490	1/20	0.34

▸	OPRD1	P41143	1/20	0.34

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
SCHEMBL9542855	0.90	ACE (0.39)	ACEKMT2A
SCHEMBL9542419	0.90	ACE (0.39)	ACEKMT2A
SCHEMBL9545311	0.90	PRMT5 (0.39)	ACEKMT2ANAMPTOPRD1
SCHEMBL9544041	0.89	OPRD1 (0.40)	OPRD1
SCHEMBL9542668	0.87	HTRA1 (0.39)	NAMPTOPRD1
SCHEMBL9542442	0.87	HTRA1 (0.39)	NAMPTOPRD1
SCHEMBL9544396	0.87	OPRD1 (0.39)	OPRD1
SCHEMBL9544094	0.87	OPRD1 (0.39)	OPRD1
SCHEMBL9544287	0.82	OPRD1 (0.47)	OPRD1
SCHEMBL9543518	0.80	ACE (0.43)	ACEKMT2A

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
WO-1993020099-A2	CCK AND/OR GASTRIN RECEPTOR LIGANDS	FERRING B.V. (NL)	1993-10-14	—	—	WO	disclosed