SCHEMBL19650509

SCHEMBL19650509

O=NCNc1cc(Nc2nc(Cl)nc(NCCS(=O)(=O)O)n2)ccc1/N=N/c1cc2c(S(=O)(=O)O)cc(S(=O)(=O)O)cc2cc1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.43
▸ CA9 Q16790 5/20 0.39
▸ CA12 O43570 4/20 0.39
▸ CA1 P00915 4/20 0.39
▸ CA2 P00918 4/20 0.39
▸ CA14 Q9ULX7 3/20 0.39
▸ CA5A P35218 1/20 0.36
▸ CA5B Q9Y2D0 1/20 0.36
▸ CHAT P28329 3/20 0.35
▸ USP2 O75604 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT1 Q99873 1/20 0.33
▸ HPGDS O60760 1/20 0.32
▸ CD40 P25942 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
SCHEMBL20685430 0.87 FUT8 (0.40) FUT8CA9CA12CA1CA2
SCHEMBL20692440 0.87 FUT8 (0.45) FUT8CA9CA12CA1CA2
SCHEMBL15800375 0.84 FUT8 (0.40) FUT8CA9CA12CA1CA2
SCHEMBL20314644 0.79 FUT8 (0.42) FUT8CA9CA12CA1CA2
SCHEMBL8601003 0.78 FUT8 (0.42) FUT8CA9CA12CA1CA2
SCHEMBL8601012 0.78 FUT8 (0.42) FUT8CA9CA12CA1CA2
SCHEMBL9270771 0.78 FUT8 (0.48) FUT8CA9CA12CA1CA2
SCHEMBL9740928 0.78 FUT8 (0.48) FUT8CA9CA12CA1CA2
SCHEMBL9154680 0.78 FUT8 (0.46) FUT8CA9CA12CA1CA2
SCHEMBL20685369 0.78 FUT8 (0.38) FUT8CHATUSP2APEX1ENPP3

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
EP-2743318-B1 GRAY INK COMPOSITION FOR INK JET PRINTING AND METHOD FOR PRINTING FIBERS USING SAME NIPPON KAYAKU KK (JP) 2017-11-29 — — EP disclosed
Send feedback