SCHEMBL12733112

SCHEMBL12733112

C=CS(=O)(=O)c1ccc(N=Nc2c(S(=O)(=O)O)cc3ccc(NNc4ccc(C)cc4)c(O)c3c2N)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ SUMO2 P61956 1/20 0.41
▸ SUMO1 P63165 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP2 Q9HC62 1/20 0.41
▸ CA2 P00918 1/20 0.40
▸ CA3 P07451 1/20 0.40
▸ THRB P10828 1/20 0.39
▸ PRMT1 Q99873 1/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.37
▸ CD40 P25942 1/20 0.36
▸ CD40LG P29965 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL17109628 0.80 ENPP2 (0.51) ENPP2CYP1A2SUMO2SUMO1SENP7
SCHEMBL15671895 0.80 THRB (0.55) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL17109636 0.79 MEN1 (0.48) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL13763489 0.79 ENPP2 (0.51) ENPP2CYP1A2CYP2C9CA2CA3
SCHEMBL17148649 0.77 ENPP2 (0.48) ENPP2CYP1A2SUMO2SUMO1SENP7
SCHEMBL17676441 0.76 ENPP2 (0.58) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL10487424 0.75 ENPP2 (0.58) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL17109640 0.74 PRMT1 (0.62) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL13151798 0.73 ENPP2 (0.53) ENPP2CYP1A2CYP2C9SUMO2SUMO1
SCHEMBL14271178 0.73 ENPP2 (0.48) ENPP2CYP1A2THRBPRMT1PHLPP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7919221-B2 colorant comprises an azo dye having at least one reactive group selected from SO2CnH2nOSO3H, NHCOCnH2nOSO3H, NHSO2CnH2nOSO3H, COCnH2nOSO3H and SO2CH .dbd. CH2 ( n=1-4 ); a resin such as Laurylmethacrylate/methylmethacrylate/methacrylic;acid (80/10/10) copolymer containing isoparaffinic solvent RICOH COMPANY, LTD. (JP) 2011-04-05 — — US disclosed
US-20080199791-A1 ELECTROPHOTOGRAPHIC PRINTING TONER, ELECTROPHOTOGRAPHIC PRINTING METHOD AND LIQUID DEVELOPER FOR ELECTROPHOTOGRAPHIC PRINTING RICOH COMPANY, LTD. (JP) 2008-08-21 — — US disclosed
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