SCHEMBL30712758

CC[C@H](C)[C@H](NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	2/20	0.50

▸	GLP1R	P43220	5/20	0.50

▸	BACE1	P56817	3/20	0.48

▸	KISS1R	Q969F8	2/20	0.47

▸	GRIN2D	O15399	1/20	0.47

▸	GRIN3B	O60391	1/20	0.47

▸	GRIN1	Q05586	1/20	0.47

▸	GRIN2A	Q12879	1/20	0.47

▸	GRIN2B	Q13224	1/20	0.47

▸	GRIN2C	Q14957	1/20	0.47

▸	GRIN3A	Q8TCU5	1/20	0.47

▸	VIPR2	P41587	2/20	0.47

▸	BACE2	Q9Y5Z0	1/20	0.47

▸	TFPI	P10646	1/20	0.47

▸	ECE1	P42892	1/20	0.47

▸	MUS81	Q96NY9	1/20	0.47

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
SCHEMBL30618090	0.97	VIPR1 (0.52)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL29353346	0.97	VIPR1 (0.53)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL30752382	0.97	VIPR1 (0.53)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL29907889	0.97	VIPR1 (0.53)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL31622480	0.97	VIPR1 (0.52)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL30752385	0.96	VIPR1 (0.52)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL30752387	0.96	VIPR1 (0.52)	VIPR1GLP1RBACE1KISS1RGRIN2D
SCHEMBL31622476	0.96	VIPR1 (0.55)	VIPR1GLP1RBACE1KISS1RVIPR2
SCHEMBL30752379	0.96	VIPR1 (0.55)	VIPR1GLP1RBACE1KISS1RVIPR2
SCHEMBL15669773	0.92	TFPI (0.53)	VIPR1GLP1RBACE1KISS1RGRIN2D

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
CN-110546161-B	Insulin analogues with reduced binding to insulin receptor and uses thereof	韩美药品股份有限公司	2024-01-26	—	—	CN	disclosed