SCHEMBL13483311

SCHEMBL13483311

CCN(C)c1nc(Cl)nc(Nc2ccc(/N=N\c3c(N)ccc4cc(S(=O)(=O)O)cc(O)c34)c(S(=O)(=O)O)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 4/20 0.58
▸ FUT8 Q9BYC5 1/20 0.45
▸ APEX1 P27695 3/20 0.44
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ SUMO2 P61956 2/20 0.41
▸ SUMO1 P63165 2/20 0.41
▸ SENP7 Q9BQF6 2/20 0.41
▸ SENP2 Q9HC62 2/20 0.41
▸ CYP1A2 P05177 1/20 0.38
▸ PRMT1 Q99873 3/20 0.36
▸ SENP3 Q9H4L4 1/20 0.36
▸ SENP1 Q9P0U3 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ CHAT P28329 2/20 0.35

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
SCHEMBL14038374 0.89 ENPP2 (0.69) ENPP2FUT8APEX1CA12CA1
SCHEMBL14048509 0.86 ENPP2 (0.62) ENPP2FUT8APEX1CA12CA1
SCHEMBL12189798 0.84 ENPP2 (0.60) ENPP2FUT8APEX1CA12CA1
SCHEMBL12189797 0.84 ENPP2 (0.62) ENPP2FUT8APEX1CA12CA1
SCHEMBL16330379 0.84 ENPP2 (0.59) ENPP2FUT8APEX1CA12CA1
SCHEMBL14440892 0.83 ENPP2 (0.61) ENPP2FUT8APEX1CA12CA1
SCHEMBL13823298 0.83 ENPP2 (0.61) ENPP2FUT8APEX1CA12CA1
SCHEMBL13483284 0.83 ENPP2 (0.48) ENPP2FUT8APEX1CA12CA1
SCHEMBL7777138 0.83 ENPP2 (0.59) ENPP2FUT8APEX1CA12CA1
SCHEMBL7777133 0.83 ENPP2 (0.59) ENPP2FUT8APEX1CA12CA1

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-7666232-B2 Triazine dyes; reproducibility, leveling, washing off and toughness; mixture with yellow reactive dye comprising Color Index (C.I.) Reactive Yellow 145 and/or C.I. Reactive Yellow 176; and blue reactive dye selected from C.I. Reactive Blue 194, C.I. Reactive Blue 221 and C.I. Reactive Blue 222 EVERLIGHT USA, INC. (US) 2010-02-23 — — US disclosed
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