SCHEMBL10143509

Cc1cc(=O)[nH]c2cc(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CC(=O)OC3CCCCC3)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.51

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	CACNA1B	Q00975	5/20	0.39

▸	MDM2	Q00987	1/20	0.38

▸	CA1	P00915	1/20	0.38

▸	CA2	P00918	1/20	0.38

▸	TLR2	O60603	3/20	0.37

▸	TLR1	Q15399	1/20	0.37

▸	SIRT5	Q9NXA8	1/20	0.37

▸	TPSAB1	Q15661	1/20	0.37

▸	PARP1	P09874	1/20	0.36

▸	KMT2A	Q03164	1/20	0.35

▸	F10	P00742	1/20	0.35

▸	PRSS1	P07477	1/20	0.35

▸	HDAC4	P56524	1/20	0.35

▸	HDAC1	Q13547	1/20	0.35

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
SCHEMBL10144194	0.91	MDM2 (0.39)	MDM2CA1CA2TLR2TLR1
SCHEMBL10144432	0.90	CA1 (0.45)	MDM2CA1CA2TLR2TLR1
SCHEMBL10143518	0.90	TLR2 (0.43)	CACNA1BTLR2TPSAB1F10PRSS1
SCHEMBL10144210	0.89	MDM2 (0.40)	MDM2CA1CA2TLR2TLR1
SCHEMBL10144130	0.89	CA1 (0.39)	MDM2CA1CA2TLR2TLR1
SCHEMBL10143500	0.88	SIRT5 (0.42)	MDM2CA1CA2TLR2TLR1
SCHEMBL10143496	0.87	CA1 (0.42)	MDM2CA1CA2TLR2TLR1
SCHEMBL10144413	0.86	CA1 (0.40)	MDM2CA1CA2TLR2TLR1
SCHEMBL10143498	0.85	MDM2 (0.41)	MDM2CA1CA2SIRT5KMT2A
SCHEMBL10144419	0.85	MDM2 (0.41)	MDM2CA1CA2TPSAB1

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