SCHEMBL30168673

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	18/20	0.67

▸	GLP1R	P43220	2/20	0.58

▸	GCGR	P47871	1/20	0.58

▸	GIPR	P48546	1/20	0.58

▸	ECE1	P42892	1/20	0.58

▸	MUS81	Q96NY9	1/20	0.58

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
SCHEMBL29804818	0.93	KISS1R (0.63)	KISS1R
SCHEMBL30608400	0.92	KISS1R (0.61)	KISS1RGLP1RGCGRGIPR
SCHEMBL29594804	0.91	GLP1R (0.65)	KISS1RGLP1RGCGRGIPRECE1
SCHEMBL30849089	0.91	GLP1R (0.63)	KISS1RGLP1RGCGRGIPR
SCHEMBL30262099	0.90	GLP1R (0.62)	KISS1RGLP1RGCGRGIPRECE1
SCHEMBL29464012	0.90	KISS1R (0.69)	KISS1R
SCHEMBL21973851	0.89	KISS1R (0.61)	KISS1RGLP1RGCGRGIPRECE1
SCHEMBL31238593	0.89	KISS1R (0.65)	KISS1R
SCHEMBL30130570	0.89	MAGI3 (0.58)	KISS1RGLP1RECE1MUS81
SCHEMBL32662800	0.88	KISS1R (0.74)	KISS1R

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
EP-4126921-A2	QD DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF	Takeda Pharmaceutical Company Limited (JP)	2023-02-08	—	—	EP	claimed