SCHEMBL21392390

CNC(CCNC(=O)CCC(NC(=O)CCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccccc1)C(=O)N[C@H](C=O)CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	7/20	0.50

▸	KISS1R	Q969F8	6/20	0.49

▸	NPBWR1	P48145	1/20	0.47

▸	CTSL	P07711	2/20	0.46

▸	CTSS	P25774	2/20	0.46

▸	CTSK	P43235	2/20	0.46

▸	CTSH	P09668	1/20	0.46

▸	CCKBR	P32239	1/20	0.45

▸	NPFFR1	Q9GZQ6	1/20	0.45

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
SCHEMBL18716922	0.91	MC4R (0.55)	MC4RKISS1RCTSLCTSSCTSK
SCHEMBL21392382	0.91	KISS1R (0.53)	MC4RKISS1RCTSLCTSSCTSK
SCHEMBL18717207	0.89	MC4R (0.53)	MC4RKISS1RCTSLCTSSCTSK
SCHEMBL18717198	0.88	MC4R (0.53)	MC4RKISS1RCTSLCTSSCTSK
SCHEMBL21392376	0.86	MC4R (0.45)	MC4RKISS1RCTSLCTSSCTSK
SCHEMBL5501891	0.86	KISS1R (0.55)	MC4RKISS1RNPBWR1
SCHEMBL14811912	0.85	MC4R (0.57)	MC4RKISS1RNPBWR1CCKBR
SCHEMBL18716898	0.84	MC4R (0.56)	MC4R
SCHEMBL18716912	0.84	MC4R (0.58)	MC4R
SCHEMBL15691474	0.84	NPBWR1 (0.52)	MC4RKISS1RNPBWR1CTSLCTSS

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
WO-2019183472-A1	MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDE FORMULATIONS AND METHODS FOR GASTROINTESTINAL TRACT-SPECIFIC DELIVERY	PALATIN TECHNOLOGIES, INC. (US)	2019-09-26	—	—	WO	disclosed