SCHEMBL17384197

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)C)[C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCOC(=O)[C@H](C)N)OC

nearest known ligand 0.41

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	REN	P00797	2/20	0.40

▸	CTSD	P07339	6/20	0.39

▸	ANPEP	P15144	1/20	0.37

▸	LNPEP	Q9UIQ6	1/20	0.37

▸	RAMP1	O60894	1/20	0.37

▸	CALCRL	Q16602	1/20	0.37

▸	CYP3A4	P08684	1/20	0.36

▸	ACE	P12821	1/20	0.36

▸	ACE2	Q9BYF1	1/20	0.36

▸	AGTR1	P30556	2/20	0.36

▸	AGTR2	P50052	2/20	0.36

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
SCHEMBL16645063	0.93	REN (0.41)	RENANPEPLNPEPACEACE2
SCHEMBL16645135	0.92	REN (0.43)	RENCTSDANPEPLNPEPRAMP1
SCHEMBL20224718	0.91	CYP3A4 (0.43)	RENCTSDANPEPLNPEPCALCRL
SCHEMBL17381819	0.90	REN (0.40)	RENCTSDANPEPLNPEPCYP3A4
SCHEMBL16645091	0.90	REN (0.40)	RENCTSDANPEPLNPEPCYP3A4
SCHEMBL16645016	0.89	REN (0.42)	RENCTSDACEACE2
SCHEMBL22273459	0.88	ANPEP (0.41)	RENCTSDANPEPLNPEPRAMP1
SCHEMBL18610762	0.87	CTSD (0.39)	RENCTSDANPEPLNPEPRAMP1
SCHEMBL16645013	0.86	REN (0.40)	RENCTSDANPEPLNPEPCYP3A4
SCHEMBL16645207	0.86	REN (0.40)	RENACEACE2

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-2015195925-A1	PROTEIN-POLYMER-DRUG CONJUGATES AND METHODS OF USING SAME	MERSANA THERAPEUTICS, INC. (US)	2015-12-23	—	—	WO	disclosed