SCHEMBL31511426

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

nearest known ligand 0.58

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	MAPK8	P45983	1/20	0.57

▸	MAPK9	P45984	1/20	0.57

▸	MAPK10	P53779	1/20	0.57

▸	KEAP1	Q14145	2/20	0.57

▸	NMUR2	Q9GZQ4	5/20	0.56

▸	NMUR1	Q9HB89	5/20	0.56

▸	NTSR1	P30989	2/20	0.55

▸	EPHA2	P29317	2/20	0.55

▸	NTSR2	O95665	1/20	0.55

▸	OPRD1	P41143	2/20	0.54

▸	F2	P00734	2/20	0.53

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
SCHEMBL30974287	0.90	MAPK8 (0.60)	MAPK8MAPK9MAPK10KEAP1NMUR2
SCHEMBL31511428	0.88	OPRD1 (0.58)	KEAP1NMUR2NMUR1EPHA2OPRD1
SCHEMBL31124657	0.88	EPHA2 (0.57)	MAPK8MAPK9MAPK10NMUR2NMUR1
SCHEMBL23895420	0.86	OPRD1 (0.62)	NTSR1OPRD1
SCHEMBL31129136	0.86	OPRD1 (0.56)	NMUR2NMUR1NTSR1EPHA2OPRD1
SCHEMBL30753221	0.86	NMUR2 (0.61)	NMUR2NMUR1NTSR1EPHA2NTSR2
SCHEMBL8780556	0.86	NTSR1 (0.59)	KEAP1NMUR2NMUR1NTSR1EPHA2
SCHEMBL8780544	0.86	NTSR1 (0.59)	KEAP1NMUR2NMUR1NTSR1EPHA2
SCHEMBL31296998	0.86	NPY2R (0.57)	MAPK8MAPK9MAPK10NMUR2NMUR1
SCHEMBL23895410	0.86	OPRD1 (0.60)	NMUR2NMUR1NTSR1EPHA2OPRD1

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-119842845-A	Food-borne supplement for preventing iron deficiency symptoms	江南大学	2025-04-18	—	—	CN	claimed
CN-119842845-A	Food-borne supplement for preventing iron deficiency symptoms	江南大学	2025-04-18	—	—	CN	disclosed