SCHEMBL10144110

CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)[C@H](COCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)Nc1ccc2c(C(F)(F)F)cc(=O)[nH]c2c1

nearest known ligand 0.50

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MDM2	Q00987	1/20	0.39

▸	SIRT1	Q96EB6	8/20	0.39

▸	TDP1	Q9NUW8	1/20	0.39

▸	SIRT2	Q8IXJ6	8/20	0.38

▸	SIRT5	Q9NXA8	2/20	0.38

▸	MEN1	O00255	1/20	0.38

▸	KMT2A	Q03164	1/20	0.38

▸	L3MBTL1	Q9Y468	1/20	0.38

▸	PTPN1	P18031	1/20	0.38

▸	CTSS	P25774	1/20	0.38

▸	CA1	P00915	1/20	0.38

▸	CA2	P00918	1/20	0.38

▸	SIRT3	Q9NTG7	3/20	0.37

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
SCHEMBL10143498	0.93	MDM2 (0.41)	MDM2SIRT1TDP1SIRT2SIRT5
SCHEMBL10144196	0.90	TLR2 (0.43)	MDM2PTPN1
SCHEMBL10143385	0.88	MDM2 (0.38)	MDM2SIRT5KMT2ACA1CA2
SCHEMBL10144432	0.85	CA1 (0.45)	MDM2TDP1SIRT5KMT2ACA1
SCHEMBL10143500	0.83	SIRT5 (0.42)	MDM2SIRT5KMT2APTPN1CA1
SCHEMBL10143401	0.83	TLR2 (0.46)	PTPN1
SCHEMBL10144109	0.82	MDM2 (0.42)	MDM2SIRT1SIRT2SIRT5MEN1
SCHEMBL10143496	0.82	CA1 (0.42)	MDM2TDP1SIRT5KMT2ACA1
SCHEMBL10144419	0.81	MDM2 (0.41)	MDM2TDP1CA1CA2
SCHEMBL10143586	0.81	MDM2 (0.42)	MDM2SIRT1SIRT2MEN1KMT2A

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-2012009258-A2	PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS	ROBERTS EDWARD (US)	2012-01-19	—	—	WO	disclosed