SCHEMBL8907994

O=C([O-])CCc1cccc(-c2c3nc(c(-c4cccc(CCC(=O)[O-])c4)c4ccc([nH]4)c(-c4cccc(CCC(=O)[O-])c4)c4nc(c(-c5cccc(CCC(=O)[O-])c5)c5ccc2[nH]5)C=C4)C=C3)c1.O=C([O-])CCc1cccc(-c2c3nc(c(-c4cccc(CCC(=O)[O-])c4)c4ccc([nH]4)c(-c4cccc(CCC(=O)[O-])c4)c4nc(c(-c5cccc(CCC(=O)[O-])c5)c5ccc2[nH]5)C=C4)C=C3)c1.O=C([O-])CCc1cccc(-c2c3nc(c(-c4cccc(CCC(=O)[O-])c4)c4ccc([nH]4)c(-c4cccc(CCC(=O)[O-])c4)c4nc(c(-c5cccc(CCC(=O)[O-])c5)c5ccc2[nH]5)C=C4)C=C3)c1.[Mn+3].[Mn+3].[Mn+3].[Mn+3]

nearest known ligand 0.53

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	TOP1	P11387	3/20	0.45

▸	CYCS	P99999	4/20	0.44

▸	ENPP2	Q13822	1/20	0.43

▸	FFAR1	O14842	5/20	0.39

▸	PPARG	P37231	1/20	0.39

▸	TERT	O14746	3/20	0.39

▸	ABCG2	Q9UNQ0	1/20	0.39

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
Hydrochloric Acid SCHEMBL8865123	0.99	TOP1 (0.44)	TOP1CYCSENPP2FFAR1PPARG
SCHEMBL8908306	0.89	TOP1 (0.48)	TOP1CYCSENPP2PPARGTERT
Hydrochloric Acid SCHEMBL8865260	0.88	TOP1 (0.47)	TOP1CYCSENPP2PPARGTERT
SCHEMBL8908003	0.86	FFAR1 (0.51)	TOP1CYCSFFAR1PPARG
SCHEMBL8865842	0.81	PDE3B (0.48)	TOP1CYCSFFAR1ABCG2
SCHEMBL8909582	0.80	TOP1 (0.44)	TOP1CYCSENPP2TERTABCG2
SCHEMBL8865339	0.79	SYK (0.40)	TOP1CYCSFFAR1ABCG2
Hydrochloric Acid SCHEMBL8865595	0.79	TOP1 (0.43)	TOP1CYCSENPP2TERTABCG2
SCHEMBL1640460	0.79	TERT (0.50)	TOP1CYCSENPP2TERT
SCHEMBL8909228	0.79	GRIN2D (0.53)	TOP1CYCSENPP2PPARGTERT

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
EP-0684948-B1	MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME	DIAGNOSTIKFORSCHUNG INST (DE)	1997-10-22	—	—	EP	claimed