SCHEMBL14625467

SCHEMBL14625467

C=CS(=O)(=O)CCNc1nc(NCCS(=O)(=O)C=C)c(/N=N/c2cc(Nc3nc(Cl)nc(Nc4ccc(S(=O)(=O)C=C)cc4)n3)ccc2S(=O)(=O)O)c(C)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.40
▸ CA9 Q16790 11/20 0.38
▸ CA12 O43570 10/20 0.38
▸ CA1 P00915 10/20 0.38
▸ CA2 P00918 10/20 0.38
▸ CA14 Q9ULX7 5/20 0.38
▸ CHAT P28329 3/20 0.38
▸ USP2 O75604 2/20 0.38
▸ APEX1 P27695 2/20 0.38
▸ CA5A P35218 1/20 0.36
▸ CA5B Q9Y2D0 1/20 0.36
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ HPGDS O60760 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ GAA P10253 1/20 0.32

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL14030084 0.95 CA9 (0.36) FUT8CA9CA12CA1CA2
SCHEMBL14625466 0.92 CHAT (0.44) FUT8CA9CA12CA1CA2
SCHEMBL14004638 0.90 FUT8 (0.38) FUT8CA9CA12CA1CA2
SCHEMBL14004624 0.85 FUT8 (0.35) FUT8CA9CA12CA1CA2
SCHEMBL14004622 0.85 FUT8 (0.35) FUT8CA9CA12CA1CA2
SCHEMBL14625465 0.82 PRMT1 (0.38) ENPP1MEN1MAPTKMT2ATDP1
SCHEMBL14029608 0.81 FUT8 (0.39) FUT8CA9CA12CA1CA2
SCHEMBL14030079 0.77 FUT8 (0.36) FUT8CA9CA12CA1CA2
SCHEMBL14004637 0.76 FUT8 (0.33) FUT8
SCHEMBL14029568 0.76 ENPP2 (0.43) ENPP1MEN1MAPTCYP2C9KMT2A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007006594-A2 REACTIVE AZO DYES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-01-18 — — WO disclosed
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