SCHEMBL17384283

SCHEMBL17384283

C=CS(=O)(=O)c1cccc(N(CC)c2nc(Cl)nc(Nc3ccc(/N=N/c4ccc(/N=N/c5c(N)ccc6cc(S(=O)(=O)O)cc(O)c56)c(S(=O)(=O)O)c4)c(NC(C)=O)c3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.45
▸ FUT8 Q9BYC5 1/20 0.39
▸ PRMT1 Q99873 1/20 0.35
▸ SUMO2 P61956 1/20 0.34
▸ SUMO1 P63165 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP2 Q9HC62 1/20 0.34
▸ APEX1 P27695 2/20 0.33
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ CYP1A2 P05177 1/20 0.31
▸ ENPP3 O14638 1/20 0.31
▸ ENPP1 P22413 1/20 0.31
▸ CHAT P28329 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL17384214 0.87 ENPP2 (0.52) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL13483284 0.82 ENPP2 (0.48) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL17384270 0.80 ENPP2 (0.47) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL17384286 0.80 ENPP2 (0.49) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL13483311 0.78 ENPP2 (0.58) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL17384224 0.77 ENPP2 (0.62) ENPP2PRMT1SUMO2SUMO1SENP7
SCHEMBL14149031 0.76 FUT8 (0.46) ENPP2FUT8PRMT1APEX1CD40
SCHEMBL17384128 0.76 ENPP2 (0.51) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL13823298 0.76 ENPP2 (0.61) ENPP2FUT8PRMT1SUMO2SUMO1
SCHEMBL14440892 0.76 ENPP2 (0.61) ENPP2FUT8PRMT1SUMO2SUMO1

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-2015193104-A1 MIXTURES OF REACTIVE DYES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2015-12-23 — — WO disclosed
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