SCHEMBL29468879

CC[C@H](C)[C@H](NC(=O)[C@H](COC(C)(C)C)NC(=O)[C@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@@H](N)COC(C)(C)C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	ABCB1	P08183	1/20	0.41

▸	CTSD	P07339	5/20	0.41

▸	MMP1	P03956	2/20	0.40

▸	MME	P08473	8/20	0.38

▸	ACE	P12821	8/20	0.38

▸	CPA1	P15085	8/20	0.38

▸	ACE2	Q9BYF1	8/20	0.38

▸	KMT2A	Q03164	1/20	0.38

▸	GRB2	P62993	1/20	0.38

▸	PTPN1	P18031	1/20	0.37

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
SCHEMBL29468820	0.95	ABCB1 (0.42)	ABCB1CTSDMMP1MMEACE
SCHEMBL30422838	0.92	CTSD (0.42)	ABCB1CTSDMMP1GRB2PTPN1
SCHEMBL29468876	0.91	CTSD (0.41)	ABCB1CTSDMMP1MMEACE
SCHEMBL30422599	0.88	CTSD (0.44)	ABCB1CTSDMMP1MMEACE
SCHEMBL30422538	0.88	CTSD (0.44)	ABCB1CTSDMMP1MMEACE
SCHEMBL29468853	0.88	GRB2 (0.43)	CTSDMMEACECPA1ACE2
SCHEMBL30422261	0.87	CTSD (0.43)	ABCB1CTSDMMP1GRB2
SCHEMBL30422766	0.83	CTSD (0.42)	ABCB1CTSDMMP1PTPN1
SCHEMBL30863604	0.80	ACACB (0.43)	CTSDACEGRB2PTPN1
SCHEMBL30250661	0.79	ITGB3 (0.44)	ABCB1MMEACECPA1ACE2

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
EP-4204440-A1	GLP-1/GIP DUAL AGONISTS	Sun Pharmaceutical Industries Limited (IN)	2023-07-05	—	—	EP	disclosed
WO-2022079639-A1	GLP-1/GIP DUAL AGONISTS	SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN)	2022-04-21	—	—	WO	disclosed