SCHEMBL30432537

CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCNC(C)=C1C(=O)CC(C)(C)CC1=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	3/20	0.55

▸	NPY2R	P49146	8/20	0.55

▸	NPY4R	P50391	8/20	0.55

▸	NPY5R	Q15761	8/20	0.55

▸	TFPI	P10646	6/20	0.55

▸	NPY1R	P25929	6/20	0.55

▸	MAOB	P27338	1/20	0.53

▸	KDM5A	P29375	1/20	0.53

▸	KDM1B	Q8NB78	1/20	0.53

▸	HSP90AB1	P08238	1/20	0.51

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
SCHEMBL30434390	0.81	NPY2R (0.48)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL31276264	0.81	TFPI (0.64)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL30176453	0.80	NPY2R (0.64)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL29514978	0.80	KDM1A (0.64)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL29903370	0.80	NPY2R (0.64)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL30658285	0.80	NPY2R (0.72)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL30883237	0.80	NPY2R (0.63)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL30607334	0.80	NPY2R (0.68)	KDM1ANPY2RNPY4RNPY5RTFPI
SCHEMBL31182963	0.79	TFPI (0.68)	NPY2RNPY4RNPY5RTFPINPY1R
SCHEMBL30444760	0.79	CALCR (0.51)	—

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-110694056-B	FSH antigen, preparation method thereof and FSH vaccine containing FSH antigen	四川农业大学	2023-05-05	—	—	CN	disclosed