SCHEMBL30862330

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.66

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	6/20	0.62

▸	ECE1	P42892	1/20	0.62

▸	MUS81	Q96NY9	1/20	0.62

▸	VIPR1	P32241	3/20	0.61

▸	TFPI	P10646	1/20	0.60

▸	VIPR2	P41587	5/20	0.60

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
SCHEMBL30335650	0.94	GLP1R (0.63)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL30432941	0.92	VIPR1 (0.63)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL30648475	0.92	GLP1R (0.61)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL30429336	0.92	VIPR1 (0.65)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL31000883	0.90	GLP1R (0.63)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL30495613	0.90	VIPR1 (0.66)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL31182890	0.90	TFPI (0.67)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL31000926	0.90	GLP1R (0.65)	GLP1RECE1MUS81VIPR1TFPI
SCHEMBL30906375	0.89	GLP1R (0.71)	GLP1RECE1MUS81
SCHEMBL30335972	0.89	GLP1R (0.59)	GLP1RECE1MUS81VIPR1TFPI

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-20240124552-A1	METHODS AND COMPOSITIONS FOR GENERATING AN IMMUNE RESPONSE BY INDUCING CD40 AND PATTERN RECOGNITION RECEPTOR ADAPTERS	BAYLOR COLLEGE OF MEDICINE	2024-04-18	—	—	US	disclosed