SCHEMBL18116796

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

nearest known ligand 0.51

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.51

▸	IL23R	Q5VWK5	3/20	0.47

▸	APLNR	P35414	1/20	0.47

▸	F2	P00734	4/20	0.47

▸	GLP1R	P43220	2/20	0.47

▸	SCTR	P47872	1/20	0.47

▸	MC4R	P32245	1/20	0.46

▸	KISS1R	Q969F8	1/20	0.46

▸	NPY1R	P25929	1/20	0.45

▸	NPY2R	P49146	1/20	0.45

▸	NPY4R	P50391	1/20	0.45

▸	NPY5R	Q15761	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
SCHEMBL16455571	0.93	TFPI (0.45)	TFPIIL23RAPLNRGLP1RSCTR
SCHEMBL18388624	0.93	APLNR (0.47)	TFPIAPLNRGLP1RSCTRMC4R
SCHEMBL16455222	0.92	GLP1R (0.51)	TFPIAPLNRGLP1RSCTRMC4R
SCHEMBL8893440	0.86	TFPI (0.57)	TFPIIL23RF2GLP1RSCTR
SCHEMBL8895830	0.86	TFPI (0.57)	TFPIIL23RF2GLP1RSCTR
SCHEMBL30419550	0.83	GLP1R (0.55)	TFPIGLP1RSCTR
SCHEMBL29445552	0.83	GLP1R (0.55)	TFPIGLP1RSCTR
SCHEMBL29519652	0.82	NPY4R (0.54)	APLNRGLP1RSCTRKISS1RNPY1R
SCHEMBL16455229	0.82	GLP1R (0.47)	TFPIAPLNRGLP1RSCTR
SCHEMBL31388269	0.82	NPY4R (0.63)	KISS1RNPY1RNPY2RNPY4RNPY5R

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
US-9458449-B2	Hybrid polymers, pharmaceutical compositions and methods of synthesizing the same	NEW YORK UNIVERSITY (US)	2016-10-04	—	—	US	disclosed