SCHEMBL30576938

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

nearest known ligand 0.68

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.68

▸	VIPR1	P32241	4/20	0.64

▸	VIPR2	P41587	6/20	0.61

▸	GLP1R	P43220	1/20	0.60

▸	GCGR	P47871	1/20	0.60

▸	GIPR	P48546	1/20	0.60

▸	KDM1A	O60341	2/20	0.56

▸	NPY1R	P25929	1/20	0.56

▸	NPY2R	P49146	1/20	0.56

▸	NPY4R	P50391	1/20	0.56

▸	NPY5R	Q15761	1/20	0.56

▸	NR3C1	P04150	1/20	0.56

▸	MAOB	P27338	1/20	0.55

▸	KDM5A	P29375	1/20	0.55

▸	KDM1B	Q8NB78	1/20	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
SCHEMBL29558454	0.97	TFPI (0.69)	TFPIVIPR1VIPR2GLP1RGCGR
SCHEMBL30512630	0.93	NPY4R (0.63)	TFPIVIPR1VIPR2NPY1RNPY2R
SCHEMBL29649232	0.93	TFPI (0.66)	TFPIVIPR1VIPR2GLP1RGCGR
SCHEMBL29453341	0.92	VIPR1 (0.72)	TFPIVIPR1VIPR2GLP1RGCGR
SCHEMBL31047374	0.92	TFPI (0.66)	TFPIVIPR1VIPR2GLP1RGCGR
SCHEMBL30262077	0.91	TFPI (0.67)	TFPIVIPR1VIPR2
SCHEMBL30601869	0.91	TFPI (0.79)	TFPIVIPR1VIPR2GLP1RNR3C1
SCHEMBL30436216	0.91	TFPI (0.79)	TFPIVIPR1VIPR2GLP1RNR3C1
SCHEMBL30037373	0.90	TFPI (0.63)	TFPIVIPR1VIPR2GLP1RGCGR
SCHEMBL30015428	0.90	NPY4R (0.63)	TFPINPY1RNPY2RNPY4RNPY5R

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
CN-116621961-A	Gene ZmAPC4 for regulating starch content in corn kernel, expression product, SNP marker, excellent haplotype and application	河南农业大学	2023-08-22	—	—	CN	disclosed