SCHEMBL2448723

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	5/20	0.67

▸	CRHR1	P34998	1/20	0.60

▸	CRHR2	Q13324	1/20	0.60

▸	MAPK8	P45983	1/20	0.56

▸	MAPK9	P45984	1/20	0.56

▸	MAPK10	P53779	1/20	0.56

▸	CCKBR	P32239	4/20	0.54

▸	GLP1R	P43220	4/20	0.54

▸	BACE1	P56817	1/20	0.54

▸	NPY2R	P49146	5/20	0.54

▸	NPY4R	P50391	5/20	0.54

▸	NPY5R	Q15761	5/20	0.54

▸	NPY1R	P25929	3/20	0.54

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
SCHEMBL2450964	0.98	CALCR (0.68)	CALCRCRHR1CRHR2MAPK8MAPK9
SCHEMBL31183004	0.94	CALCR (0.67)	CALCRCRHR1CRHR2MAPK8MAPK9
SCHEMBL31182537	0.91	CALCR (0.63)	CALCRCRHR1CRHR2NPY2RNPY4R
SCHEMBL30576927	0.90	CALCR (0.65)	CALCRCRHR1CRHR2MAPK8MAPK9
SCHEMBL30607345	0.89	CALCR (0.66)	CALCRCRHR1CRHR2BACE1NPY2R
SCHEMBL30658358	0.89	CALCR (0.77)	CALCRCRHR1CRHR2CCKBRGLP1R
SCHEMBL31182677	0.89	CALCR (0.78)	CALCRCRHR1CRHR2CCKBRGLP1R
SCHEMBL30658198	0.88	CALCR (0.70)	CALCRCRHR1CRHR2CCKBRGLP1R
SCHEMBL31656508	0.88	CALCR (0.78)	CALCRCRHR1CRHR2CCKBRGLP1R
SCHEMBL31255170	0.88	CALCR (0.68)	CALCRCRHR1CRHR2MAPK8MAPK9

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
EP-2365796-A1	FUSOGENIC PROPERTIES OF SAPOSIN C AND RELATED PROTEINS AND PEPTIDES FOR APPLICATION TO TRANSMEMBRANE DRUG DELIVERY SYSTEMS	Children's Hospital Medical Center (US)	2011-09-21	—	—	EP	disclosed
WO-2010053489-A1	FUSOGENIC PROPERTIES OF SAPOSIN C AND RELATED PROTEINS AND PEPTIDES FOR APPLICATION TO TRANSMEMBRANE DRUG DELIVERY SYSTEMS	CHILDREN'S HOSPITAL MEDICAL CENTER (US)	2010-05-14	—	—	WO	disclosed