SCHEMBL30436591

CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C

nearest known ligand 0.70

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR1	P32241	3/20	0.65

▸	GLP1R	P43220	2/20	0.63

▸	CCKBR	P32239	1/20	0.63

▸	PTH1R	Q03431	2/20	0.63

▸	RXFP1	Q9HBX9	1/20	0.62

▸	VIPR2	P41587	4/20	0.62

▸	GCGR	P47871	1/20	0.62

▸	GIPR	P48546	1/20	0.62

▸	TFPI	P10646	1/20	0.61

▸	NPY2R	P49146	2/20	0.60

▸	NPY4R	P50391	2/20	0.60

▸	NPY5R	Q15761	2/20	0.60

▸	NPY1R	P25929	1/20	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
SCHEMBL30607451	0.94	VIPR1 (0.69)	VIPR1GLP1RCCKBRVIPR2GCGR
SCHEMBL30607324	0.94	VIPR1 (0.65)	VIPR1GLP1RCCKBRPTH1RRXFP1
SCHEMBL29403715	0.92	VIPR1 (0.72)	VIPR1GLP1RCCKBRPTH1RVIPR2
SCHEMBL29624097	0.92	VIPR1 (0.68)	VIPR1GLP1RPTH1RVIPR2TFPI
SCHEMBL30432112	0.91	RXFP1 (0.60)	VIPR1GLP1RCCKBRPTH1RRXFP1
SCHEMBL30176435	0.91	VIPR1 (0.69)	VIPR1GLP1RCCKBRVIPR2GCGR
SCHEMBL30176428	0.91	PTH1R (0.70)	VIPR1GLP1RCCKBRPTH1RRXFP1
SCHEMBL30432939	0.91	PTH1R (0.65)	VIPR1GLP1RCCKBRPTH1RRXFP1
SCHEMBL30432173	0.91	VIPR1 (0.69)	VIPR1GLP1RCCKBRPTH1RVIPR2
SCHEMBL34139	0.91	GLP1R (0.71)	VIPR1GLP1RCCKBRPTH1RRXFP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116103323-B	Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof	安徽中医药大学	2024-10-22	—	—	CN	disclosed
CN-116103323-A	Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof	安徽中医药大学	2023-05-12	—	—	CN	disclosed