SCHEMBL13604278

COc1cc(/N=N/c2cc3c(S(=O)(=O)O)cc(SOOO)cc3cc2S(=O)(=O)O)c(NC(C)=O)cc1Nc1nc(Cl)nc(Nc2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	FUT8	Q9BYC5	1/20	0.35

▸	POLB	P06746	1/20	0.32

▸	CA12	O43570	1/20	0.31

▸	CA1	P00915	1/20	0.31

▸	CA2	P00918	1/20	0.31

▸	CA9	Q16790	1/20	0.31

▸	CA14	Q9ULX7	1/20	0.31

▸	CARM1	Q86X55	1/20	0.31

▸	PRMT1	Q99873	1/20	0.31

▸	PTK2	Q05397	2/20	0.31

▸	CHRNA7	P36544	1/20	0.31

▸	ENPP2	Q13822	1/20	0.30

▸	EGFR	P00533	1/20	0.30

▸	KDR	P35968	1/20	0.30

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
SCHEMBL13604284	0.91	FUT8 (0.35)	FUT8POLBCA12CA1CA2
SCHEMBL13793456	0.86	FUT8 (0.36)	FUT8CA12CA1CA2CA9
SCHEMBL13604230	0.86	FUT8 (0.36)	FUT8CA12CA1CA2CA9
SCHEMBL13599483	0.86	FUT8 (0.36)	FUT8CA12CA1CA2CA9
SCHEMBL14372026	0.81	FUT8 (0.37)	FUT8POLBCA12CA1CA2
SCHEMBL13599477	0.81	CHAT (0.36)	FUT8CA12CA1CA2CA9
SCHEMBL13340695	0.81	CHAT (0.36)	FUT8CA12CA1CA2CA9
SCHEMBL12054196	0.80	MEN1 (0.36)	FUT8CARM1PRMT1ENPP2
SCHEMBL13599474	0.80	CA12 (0.30)	CA12CA1CA2CA9CA14
SCHEMBL13604238	0.80	CA12 (0.30)	CA12CA1CA2CA9CA14

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-20090320217-A1	MIXTURES OF FIBRE-REACTIVE AZO DYES	DYSTAR TEXTIFARBEN GMBH & CO. DEUTSCHLAND KG (DE)	2009-12-31	—	—	US	disclosed