SCHEMBL30930534

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 17)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.60

▸	APLNR	P35414	1/20	0.59

▸	C5AR1	P21730	1/20	0.58

▸	EPHA2	P29317	2/20	0.57

▸	CALCR	P30988	4/20	0.57

▸	KEAP1	Q14145	1/20	0.56

▸	CTSL	P07711	2/20	0.56

▸	CTSS	P25774	2/20	0.56

▸	CTSK	P43235	2/20	0.56

▸	CTSH	P09668	1/20	0.56

▸	GLP1R	P43220	3/20	0.55

▸	GCGR	P47871	2/20	0.55

▸	GIPR	P48546	2/20	0.55

▸	NPY1R	P25929	1/20	0.55

▸	NPY2R	P49146	1/20	0.55

▸	NPY4R	P50391	1/20	0.55

▸	NPY5R	Q15761	1/20	0.55

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
SCHEMBL30974554	0.91	C5AR1 (0.58)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30974459	0.91	C5AR1 (0.60)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30974458	0.91	C5AR1 (0.59)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30974387	0.91	C5AR1 (0.59)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30974286	0.90	F2 (0.57)	F2APLNRC5AR1CALCRCTSL
SCHEMBL30974189	0.90	F2 (0.56)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30777525	0.89	APLNR (0.63)	F2APLNRC5AR1EPHA2
SCHEMBL30974573	0.89	C5AR1 (0.57)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL30974365	0.89	F2 (0.56)	F2APLNRC5AR1CALCRKEAP1
SCHEMBL31688333	0.89	APLNR (0.65)	F2APLNRC5AR1CALCRGLP1R

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-112029766-B	Application of double-stranded RNA	江苏仁明生物科技有限公司	2024-06-18	—	—	CN	disclosed