SCHEMBL30712886

CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.67

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	14/20	0.67

▸	ECE1	P42892	1/20	0.64

▸	MUS81	Q96NY9	1/20	0.64

▸	NR3C1	P04150	4/20	0.62

▸	IL23R	Q5VWK5	1/20	0.62

▸	KISS1R	Q969F8	1/20	0.59

▸	GCGR	P47871	1/20	0.58

▸	GIPR	P48546	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
SCHEMBL30536326	0.90	GLP1R (0.63)	GLP1RECE1MUS81KISS1R
SCHEMBL30648468	0.89	GLP1R (0.72)	GLP1RECE1MUS81NR3C1IL23R
SCHEMBL31603947	0.89	GLP1R (0.78)	GLP1RECE1MUS81
SCHEMBL30648483	0.88	GLP1R (0.71)	GLP1RECE1MUS81NR3C1IL23R
SCHEMBL31664367	0.88	GLP1R (0.69)	GLP1RECE1MUS81
SCHEMBL31683318	0.88	GLP1R (0.68)	GLP1RECE1MUS81
SCHEMBL30906411	0.88	GLP1R (0.72)	GLP1RECE1MUS81IL23RGCGR
SCHEMBL30102558	0.88	IL23R (0.63)	GLP1RECE1MUS81IL23R
SCHEMBL31000949	0.87	GLP1R (0.75)	GLP1RECE1MUS81
SCHEMBL31688309	0.87	IL23R (0.64)	GLP1RECE1MUS81IL23RKISS1R

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
US-20240003881-A1	SYSTEM AND METHOD FOR RAPID AND SENSITIVE DETECTION OF ANTI-PATHOGEN ANTIBODIES	THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA)	2024-01-04	—	—	US	disclosed