SCHEMBL13991107

Cc1ccc(Nc2nc(Cl)nc(Nc3cc(S(=O)(=O)O)cc4cc(SOOO)c(/N=N/c5ccc6ccccc6c5S(=O)(=O)O)c(O)c34)n2)c(C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	FUT8	Q9BYC5	1/20	0.46

▸	CYP1A2	P05177	2/20	0.37

▸	ALDH1A1	P00352	2/20	0.37

▸	MEN1	O00255	2/20	0.34

▸	KMT2A	Q03164	2/20	0.34

▸	MAPK1	P28482	2/20	0.34

▸	RXFP1	Q9HBX9	1/20	0.34

▸	CYP2C9	P11712	1/20	0.34

▸	DNASE1L3	Q13609	1/20	0.34

▸	THRB	P10828	1/20	0.33

▸	ENPP2	Q13822	2/20	0.31

▸	PHLPP2	Q6ZVD8	1/20	0.31

▸	DHODH	Q02127	2/20	0.31

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
SCHEMBL13991093	0.94	FUT8 (0.48)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL12589896	0.94	FUT8 (0.48)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL14020931	0.90	FUT8 (0.52)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL14071634	0.90	FUT8 (0.52)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL13991106	0.89	FUT8 (0.59)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL14016328	0.89	FUT8 (0.41)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL12589894	0.84	FUT8 (0.45)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL13815202	0.84	FUT8 (0.45)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL12136687	0.84	FUT8 (0.56)	FUT8CYP1A2ALDH1A1MEN1KMT2A
SCHEMBL13991090	0.83	FUT8 (0.62)	FUT8CYP1A2ALDH1A1MEN1KMT2A

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
US-20080316289-A1	Composition suitable for use in ink jet printing	FUJIFILM IMAGING COLORANTS LIMITED	2008-12-25	—	—	US	disclosed