SCHEMBL30272533

CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.56

▸	CALCR	P30988	4/20	0.52

▸	MC4R	P32245	1/20	0.51

▸	NMBR	P28336	2/20	0.49

▸	GRPR	P30550	2/20	0.49

▸	CRHR1	P34998	1/20	0.48

▸	CRHR2	Q13324	1/20	0.48

▸	APLNR	P35414	1/20	0.48

▸	KISS1R	Q969F8	1/20	0.48

▸	NMUR2	Q9GZQ4	1/20	0.47

▸	NMUR1	Q9HB89	1/20	0.47

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
SCHEMBL30272452	0.98	F2 (0.56)	F2CALCRMC4RNMBRGRPR
SCHEMBL30272526	0.90	F2 (0.58)	F2CALCRMC4RKISS1RNMUR2
SCHEMBL30272525	0.87	F2 (0.56)	F2CALCRMC4RKISS1RNMUR2
SCHEMBL29798291	0.86	CALCR (0.54)	F2CALCRNMBRGRPRCRHR1
SCHEMBL30804656	0.86	F2 (0.67)	F2CALCRMC4RNMBRGRPR
SCHEMBL30272450	0.85	F2 (0.46)	F2CALCRMC4RKISS1RNMUR2
SCHEMBL29655695	0.85	F2 (0.51)	F2
SCHEMBL31031589	0.84	F2 (0.61)	F2CALCRMC4RCRHR1CRHR2
SCHEMBL31437675	0.84	REN (0.53)	F2CALCR
SCHEMBL30692437	0.84	REN (0.51)	F2NMUR2NMUR1

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-115746103-A	Preparation method of Bulevirtide	深圳市健翔生物制药有限公司	2023-03-07	—	—	CN	disclosed