SCHEMBL30536310

CCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.61

▸	VIPR2	P41587	5/20	0.57

▸	GLP1R	P43220	2/20	0.56

▸	ECE1	P42892	1/20	0.56

▸	MUS81	Q96NY9	1/20	0.56

▸	GCGR	P47871	1/20	0.56

▸	GIPR	P48546	1/20	0.56

▸	VIPR1	P32241	4/20	0.56

▸	IL23R	Q5VWK5	1/20	0.55

▸	NPY2R	P49146	4/20	0.55

▸	NPY4R	P50391	4/20	0.55

▸	NPY5R	Q15761	4/20	0.55

▸	NPY1R	P25929	3/20	0.55

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
SCHEMBL30607319	0.88	TFPI (0.71)	TFPIVIPR2GLP1RECE1MUS81
SCHEMBL30855563	0.88	TFPI (0.56)	TFPIVIPR2VIPR1IL23RNPY2R
SCHEMBL30037828	0.87	VIPR2 (0.65)	TFPIVIPR2GLP1RECE1MUS81
Mmi-0100 SCHEMBL29380469	0.86	TFPI (0.65)	TFPIVIPR2VIPR1NPY2RNPY4R
SCHEMBL30607476	0.86	TFPI (0.67)	TFPIVIPR2GLP1RECE1MUS81
SCHEMBL29679632	0.86	TFPI (0.63)	TFPIGLP1RECE1MUS81VIPR1
SCHEMBL31683267	0.86	TFPI (0.61)	TFPIVIPR2GLP1RECE1MUS81
SCHEMBL30116708	0.86	VIPR2 (0.60)	TFPIVIPR2GLP1RVIPR1IL23R
SCHEMBL30861920	0.86	TFPI (0.65)	TFPIGLP1RECE1MUS81VIPR1
SCHEMBL30484712	0.86	TFPI (0.71)	TFPIGLP1RIL23R

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-20230270838-A1	VACCINE COMPOSITIONS FOR INFLUENZA VIRUSES AND METHODS OF USE	ASCIONE RICHARD (US)	2023-08-31	—	—	US	disclosed