SCHEMBL17226103

BOC[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@H](C(N)=O)[C@@H](C)OP(=O)(O)OCC[C@H](O)CO

nearest known ligand 0.55

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	PLK1	P53350	13/20	0.55

▸	REN	P00797	5/20	0.52

▸	PLK3	Q9H4B4	3/20	0.51

▸	PLK2	Q9NYY3	3/20	0.51

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
SCHEMBL464371	0.95	PLK1 (0.60)	PLK1RENPLK3PLK2
SCHEMBL464367	0.87	PLK1 (0.61)	PLK1RENPLK3PLK2
SCHEMBL464336	0.87	PLK1 (0.61)	PLK1RENPLK3PLK2
SCHEMBL7835049	0.87	PLK1 (0.61)	PLK1RENPLK3PLK2
SCHEMBL464186	0.86	PLK1 (0.58)	PLK1RENPLK3PLK2
SCHEMBL464067	0.86	PLK1 (0.63)	PLK1RENPLK3PLK2
SCHEMBL22930126	0.85	PLK1 (0.70)	PLK1RENPLK3PLK2
SCHEMBL22930127	0.85	PLK1 (0.70)	PLK1RENPLK3PLK2
SCHEMBL22930164	0.85	PLK1 (0.70)	PLK1RENPLK3PLK2
SCHEMBL464377	0.85	PLK1 (0.70)	PLK1RENPLK3PLK2

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-9175038-B2	Peptide mimetic ligands of polo-like kinase 1 polo box domain and methods of use	THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH & HUMAN SERVICES (US)	2015-11-03	—	—	US	disclosed