SCHEMBL10144430

Cc1cc(=O)[nH]c2cc(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](Cc3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.47

Predicted protein targets (top 13)

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

▸	NMBR	P28336	1/20	0.38

▸	TLR2	O60603	1/20	0.36

▸	TLR1	Q15399	1/20	0.36

▸	CA1	P00915	1/20	0.35

▸	CA2	P00918	1/20	0.35

▸	MDM4	O15151	1/20	0.35

▸	TP53	P04637	1/20	0.35

▸	SIRT5	Q9NXA8	1/20	0.35

▸	TPSAB1	Q15661	1/20	0.35

▸	MAPT	P10636	1/20	0.34

▸	NPSR1	Q6W5P4	1/20	0.34

▸	TDP1	Q9NUW8	1/20	0.34

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
SCHEMBL10144432	0.87	CA1 (0.45)	MDM2TLR2TLR1CA1CA2
SCHEMBL10144419	0.85	MDM2 (0.41)	MDM2CA1CA2TPSAB1TDP1
SCHEMBL29702381	0.85	MDM2 (0.49)	MDM2NMBRTLR2TLR1MDM4
SCHEMBL10143500	0.85	SIRT5 (0.42)	MDM2TLR2TLR1CA1CA2
Hydrochloric Acid SCHEMBL31450109	0.85	MDM2 (0.44)	MDM2NMBRTLR2TLR1MDM4
SCHEMBL10143496	0.84	CA1 (0.42)	MDM2TLR2TLR1CA1CA2
SCHEMBL10143543	0.84	CTSS (0.40)	MDM2CA1CA2SIRT5TPSAB1
SCHEMBL10143498	0.83	MDM2 (0.41)	MDM2CA1CA2SIRT5TDP1
SCHEMBL10144194	0.82	MDM2 (0.39)	MDM2TLR2TLR1CA1CA2
SCHEMBL31450152	0.81	TLR2 (0.42)	MDM2TLR2TLR1MDM4TP53

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