SCHEMBL9545317

COC(=O)[C@H]1CCCN1C(=O)[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H](c2ccccc2)N1C(=O)[C@H]1Cc2ccccc2N1C(=O)OC(C)(C)C

nearest known ligand 0.87

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	UCHL1	P09936	2/20	0.40

▸	OPRD1	P41143	1/20	0.38

▸	KLK5	Q9Y337	1/20	0.38

▸	HDAC8	Q9BY41	1/20	0.37

▸	PREP	P48147	1/20	0.37

▸	PTPN1	P18031	1/20	0.36

▸	RIPK1	Q13546	1/20	0.36

▸	NAMPT	P43490	1/20	0.35

▸	DRD2	P14416	1/20	0.35

▸	DRD4	P21917	1/20	0.35

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
SCHEMBL9545307	1.00	UCHL1 (0.40)	UCHL1OPRD1KLK5HDAC8PREP
SCHEMBL9545324	1.00	UCHL1 (0.40)	UCHL1OPRD1KLK5HDAC8PREP
SCHEMBL9545305	1.00	UCHL1 (0.40)	UCHL1OPRD1KLK5HDAC8PREP
SCHEMBL9543556	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9543974	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9543967	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9545274	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9545268	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9543563	0.93	UCHL1 (0.41)	UCHL1OPRD1HDAC8PREPRIPK1
SCHEMBL9545352	0.91	OPRD1 (0.40)	UCHL1OPRD1KLK5HDAC8PREP

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