SCHEMBL30712955

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.70

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.58

▸	NPY4R	P50391	8/20	0.58

▸	NPY5R	Q15761	8/20	0.58

▸	NPY1R	P25929	6/20	0.58

▸	OPRD1	P41143	2/20	0.57

▸	C5AR1	P21730	1/20	0.57

▸	IL23R	Q5VWK5	1/20	0.56

▸	EP300	Q09472	1/20	0.56

▸	HIF1A	Q16665	1/20	0.56

▸	TFPI	P10646	2/20	0.56

▸	MAPK8	P45983	1/20	0.56

▸	MAPK9	P45984	1/20	0.56

▸	MAPK10	P53779	1/20	0.56

▸	GLP1R	P43220	2/20	0.55

▸	PTH1R	Q03431	1/20	0.54

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
SCHEMBL31191279	0.92	MAPK8 (0.58)	NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL30495701	0.91	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30432021	0.90	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL30576945	0.90	MAPK8 (0.56)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31182884	0.90	NPY2R (0.65)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30607375	0.90	TFPI (0.61)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31020752	0.89	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30176479	0.89	MAPK8 (0.57)	NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL29662379	0.89	KEAP1 (0.56)	OPRD1C5AR1IL23R
SCHEMBL30906560	0.89	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1REP300

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-20240003881-A1	SYSTEM AND METHOD FOR RAPID AND SENSITIVE DETECTION OF ANTI-PATHOGEN ANTIBODIES	THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA)	2024-01-04	—	—	US	disclosed