SCHEMBL13086004

CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(N)=O)C(C)OP(=O)(O)O

nearest known ligand 0.58

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	6/20	0.55

▸	NPY2R	P49146	7/20	0.53

▸	NPY4R	P50391	7/20	0.53

▸	NPY5R	Q15761	7/20	0.53

▸	NPY1R	P25929	5/20	0.53

▸	CXCL8	P10145	1/20	0.53

▸	NTSR1	P30989	1/20	0.53

▸	RAMP3	O60896	1/20	0.52

▸	CALCR	P30988	1/20	0.52

▸	NMUR2	Q9GZQ4	2/20	0.52

▸	NMUR1	Q9HB89	2/20	0.52

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
SCHEMBL13086160	0.95	TFPI (0.59)	TFPINMUR2NMUR1
SCHEMBL17722479	0.92	CXCL8 (0.62)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL17722476	0.91	TFPI (0.57)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL26454508	0.90	TFPI (0.63)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL26454697	0.89	TFPI (0.63)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL26454604	0.89	NMUR2 (0.60)	TFPINPY4RNPY5RNPY1RRAMP3
SCHEMBL17722481	0.88	TFPI (0.66)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL17722497	0.88	TFPI (0.61)	TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL13086158	0.88	NMUR2 (0.64)	TFPINMUR2NMUR1
SCHEMBL17722477	0.87	TFPI (0.63)	TFPINPY2RNPY4RNPY5RNPY1R

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-2010111737-A1	PEPTIDE AND PHOSPHOPEPTIDE SYNTHESIS VIA PHOSPHATE ASSISTED LIGATION	THE UNIVERSITY OF SYDNEY (AU)	2010-10-07	—	—	WO	disclosed