SCHEMBL9545274

CC(C)(C)OC(=O)N1c2ccccc2C[C@@H]1C(=O)N1[C@@H](C(=O)N2Cc3ccccc3C[C@@H]2C(=O)N2CCC[C@H]2C(=O)O)CC[C@H]1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	UCHL1	P09936	2/20	0.41

▸	PREP	P48147	1/20	0.38

▸	OPRD1	P41143	1/20	0.38

▸	ALDH1A1	P00352	1/20	0.38

▸	SMN1; SMN2	Q16637	1/20	0.38

▸	RIPK1	Q13546	1/20	0.38

▸	HDAC8	Q9BY41	1/20	0.35

▸	HSD17B10	Q99714	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
SCHEMBL9543563	1.00	UCHL1 (0.41)	UCHL1PREPOPRD1ALDH1A1SMN1; SMN2
SCHEMBL9545268	1.00	UCHL1 (0.41)	UCHL1PREPOPRD1ALDH1A1SMN1; SMN2
SCHEMBL9543967	1.00	UCHL1 (0.41)	UCHL1PREPOPRD1ALDH1A1SMN1; SMN2
SCHEMBL9543974	1.00	UCHL1 (0.41)	UCHL1PREPOPRD1ALDH1A1SMN1; SMN2
SCHEMBL9543556	1.00	UCHL1 (0.41)	UCHL1PREPOPRD1ALDH1A1SMN1; SMN2
SCHEMBL9545307	0.93	UCHL1 (0.40)	UCHL1PREPOPRD1RIPK1HDAC8
SCHEMBL9545324	0.93	UCHL1 (0.40)	UCHL1PREPOPRD1RIPK1HDAC8
SCHEMBL9545305	0.93	UCHL1 (0.40)	UCHL1PREPOPRD1RIPK1HDAC8
SCHEMBL9545317	0.93	UCHL1 (0.40)	UCHL1PREPOPRD1RIPK1HDAC8
SCHEMBL9544357	0.93	ACE (0.38)	—

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.

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