SCHEMBL13495278

CN(C)C(=O)c1cc(C(=O)N(C)C)cc(-c2c3nc(c(-c4cc(C(=O)N(C)C)cc(C(=O)N(C)C)c4)c4ccc([nH]4)c(-c4cc(C(=O)N(C)C)cc(C(=O)N(C)C)c4)c4nc(c(-c5cc(C(=O)N(C)C)cc(C(=O)N(C)C)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	CYCS	P99999	4/20	0.59

▸	TOP1	P11387	4/20	0.56

▸	ABCG2	Q9UNQ0	1/20	0.46

▸	ENPP2	Q13822	1/20	0.46

▸	TERT	O14746	5/20	0.46

▸	TLR8	Q9NR97	1/20	0.42

▸	TLR7	Q9NYK1	1/20	0.42

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
SCHEMBL14246889	0.82	CYCS (0.83)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL29684505	0.82	CYCS (0.83)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL5012384	0.80	TOP1 (0.60)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL30999674	0.77	CYCS (0.80)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL26089781	0.76	CYCS (0.78)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL12842182	0.75	CYCS (0.97)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL13495256	0.74	TOP1 (0.63)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL12842222	0.74	CYCS (0.70)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL26089806	0.74	CYCS (0.62)	CYCSTOP1ABCG2ENPP2TERT
SCHEMBL13495262	0.74	HPGD (0.49)	CYCSTOP1ABCG2TERT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20100035013-A1	OPTICAL RECORDING MEDIUM	MITSUBISHI KAGAKU MEDIA CO., LTD. (JP)	2010-02-11	—	—	US	disclosed
US-20100035013-A1	OPTICAL RECORDING MEDIUM	MITSUBISHI KAGAKU MEDIA CO., LTD. (JP)	2010-02-11	—	—	US	disclosed