SCHEMBL20314644

SCHEMBL20314644

NC(=O)Nc1cc(Nc2nc(Cl)nc(NCCS(=O)(=O)O)n2)ccc1/N=N/c1cc2c(S(=O)(=O)O)cccc2cc1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 3/20 0.42
▸ CA12 O43570 8/20 0.39
▸ CA1 P00915 8/20 0.39
▸ CA2 P00918 8/20 0.39
▸ CA9 Q16790 8/20 0.39
▸ CA14 Q9ULX7 3/20 0.39
▸ HPGDS O60760 1/20 0.38
▸ CHAT P28329 3/20 0.38
▸ ENPP3 O14638 1/20 0.38
▸ ENPP1 P22413 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ CA5A P35218 1/20 0.37
▸ CA5B Q9Y2D0 1/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ P2RX2 Q9UBL9 1/20 0.36
▸ P2RY1 P47900 2/20 0.34
▸ P2RY2 P41231 2/20 0.34
▸ P2RY4 P51582 2/20 0.34
▸ MEN1 O00255 1/20 0.33

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
SCHEMBL20314643 0.87 FUT8 (0.43) FUT8CA12CA1CA2CA9
SCHEMBL9270771 0.81 FUT8 (0.48) FUT8CA12CA1CA2CA9
SCHEMBL9740928 0.81 FUT8 (0.48) FUT8CA12CA1CA2CA9
SCHEMBL8601003 0.80 FUT8 (0.42) FUT8CA12CA1CA2CA9
SCHEMBL8601012 0.80 FUT8 (0.42) FUT8CA12CA1CA2CA9
SCHEMBL12172935 0.80 FUT8 (0.44) FUT8CA12CA1CA2CA9
SCHEMBL19650509 0.79 FUT8 (0.43) FUT8CA12CA1CA2CA9
SCHEMBL18218268 0.79 FUT8 (0.48) FUT8CA12CA1CA2CA9
SCHEMBL9270416 0.78 SUMO2 (0.47) FUT8CA12CA1CA2CA9
SCHEMBL9743159 0.78 SUMO2 (0.47) FUT8CA12CA1CA2CA9

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
US-20180179406-A1 INK JET INK COMPOSITION FOR TEXTILE PRINTING, INK SET, AND RECORDING METHOD SEIKO EPSON CORPORATION (JP) 2018-06-28 — — US disclosed
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