SCHEMBL30293065

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

nearest known ligand 0.48

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	ENPEP	Q07075	5/20	0.45

▸	GRIN2D	O15399	1/20	0.43

▸	GRIN3B	O60391	1/20	0.43

▸	GRIN1	Q05586	1/20	0.43

▸	GRIN2A	Q12879	1/20	0.43

▸	GRIN2B	Q13224	1/20	0.43

▸	GRIN2C	Q14957	1/20	0.43

▸	GRIN3A	Q8TCU5	1/20	0.43

▸	OPRL1	P41146	3/20	0.42

▸	BACE1	P56817	2/20	0.41

▸	TASP1	Q9H6P5	1/20	0.40

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
SCHEMBL30432328	0.88	BACE1 (0.46)	ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30571150	0.85	GRIN2D (0.47)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31722881	0.85	OPRM1 (0.46)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30659920	0.85	GRIN2D (0.59)	GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29757690	0.83	MAPK8 (0.47)	OPRL1
SCHEMBL31688348	0.83	VIPR1 (0.45)	—
SCHEMBL31267502	0.82	OPRL1 (0.42)	OPRL1BACE1
SCHEMBL29833172	0.82	ENPEP (0.59)	ENPEPBACE1
SCHEMBL29833349	0.82	ENPEP (0.64)	ENPEPBACE1
SCHEMBL30974275	0.82	OPRM1 (0.55)	OPRL1BACE1

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-112250733-B	Fluorescent molecular probe for targeted labeling of non-small cell lung cancer and application thereof	山西诺恩精准医疗器械有限责任公司	2023-05-02	—	—	CN	disclosed