SCHEMBL30140951

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

nearest known ligand 0.47

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NPY4R	P50391	12/20	0.47

▸	NPY1R	P25929	9/20	0.47

▸	NPY5R	Q15761	8/20	0.47

▸	NPY2R	P49146	5/20	0.47

▸	TFPI	P10646	1/20	0.45

▸	EGFR	P00533	1/20	0.44

▸	BACE1	P56817	1/20	0.42

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
SCHEMBL31461988	0.98	NPY4R (0.47)	NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31031601	0.95	NPY4R (0.49)	NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31031568	0.95	NPY4R (0.49)	NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30570975	0.95	NPY4R (0.50)	NPY4RNPY1RNPY5RNPY2REGFR
SCHEMBL30182730	0.94	NPY4R (0.46)	NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30263724	0.92	NPY4R (0.48)	NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30837494	0.92	NPY4R (0.48)	NPY4RNPY1RNPY5RNPY2REGFR
SCHEMBL29431060	0.92	NPY4R (0.51)	NPY4RNPY1RNPY5RNPY2REGFR
SCHEMBL31462045	0.92	TFPI (0.51)	NPY4RNPY1RNPY5RTFPIBACE1
SCHEMBL30570967	0.91	NPY4R (0.51)	NPY4RNPY1RNPY5RNPY2REGFR

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-20230050804-A1	USE OF CCDC157 GENE AND MUTANT GENES THEREOF AS MOLECULAR MARKERS IN DIAGNOSIS OF MALE INFERTILITY DISEASES	ZHEJIANG UNIVERSITY (CN)	2023-02-16	—	—	US	disclosed