SCHEMBL10143408

C=CCn1c(=O)cc(C)c2ccc(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](COCc3ccccc3)NC(=O)OCC3c4ccccc4-c4ccccc43)cc21

nearest known ligand 0.48

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	MDM2	Q00987	1/20	0.41

▸	SIRT2	Q8IXJ6	8/20	0.38

▸	SIRT1	Q96EB6	8/20	0.38

▸	TLR2	O60603	1/20	0.37

▸	TLR1	Q15399	1/20	0.37

▸	SIRT5	Q9NXA8	2/20	0.37

▸	KLK7	P49862	1/20	0.37

▸	KLK5	Q9Y337	1/20	0.37

▸	CA1	P00915	1/20	0.36

▸	CA2	P00918	1/20	0.36

▸	CTSS	P25774	1/20	0.36

▸	SIRT3	Q9NTG7	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
SCHEMBL10144109	0.93	MDM2 (0.42)	MDM2SIRT2SIRT1TLR2TLR1
SCHEMBL10143586	0.92	MDM2 (0.42)	MDM2SIRT2SIRT1SIRT3
SCHEMBL10143415	0.91	CTSS (0.42)	MDM2SIRT2SIRT1TLR2TLR1
SCHEMBL10143568	0.90	TLR2 (0.43)	MDM2TLR2
SCHEMBL10143411	0.88	MDM2 (0.40)	MDM2TLR2TLR1SIRT5KLK7
SCHEMBL10144158	0.88	MDM2 (0.41)	MDM2SIRT2SIRT1TLR2TLR1
SCHEMBL10143498	0.86	MDM2 (0.41)	MDM2SIRT2SIRT1SIRT5CA1
SCHEMBL10144445	0.83	TLR2 (0.46)	MDM2SIRT2SIRT1TLR2SIRT3
SCHEMBL10144408	0.82	TLR2 (0.47)	SIRT2SIRT1TLR2SIRT3
SCHEMBL10144449	0.81	TLR2 (0.44)	MDM2TLR2

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