SCHEMBL9626720

SCHEMBL9626720

Nc1ccc2cc(S(=O)(=O)O)c(N=Nc3cc4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4cc3S(=O)(=O)O)c(O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.51
▸ CYP1A2 P05177 3/20 0.51
▸ PRMT1 Q99873 1/20 0.49
▸ ENPP2 Q13822 5/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HTT P42858 1/20 0.48
▸ PHLPP2 Q6ZVD8 3/20 0.48
▸ CD40 P25942 1/20 0.48
▸ CD40LG P29965 1/20 0.48
▸ CYP2C9 P11712 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ DNASE1L3 Q13609 1/20 0.47
▸ NSD2 O96028 1/20 0.45
▸ DUSP3 P51452 1/20 0.45
▸ PTPN5 P54829 1/20 0.45
▸ CASP6 P55212 1/20 0.45
▸ PTPN11 Q06124 1/20 0.45
▸ SUMO2 P61956 1/20 0.45
▸ SUMO1 P63165 1/20 0.45

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
SCHEMBL9809359 1.00 NT5E (0.51) NT5ECYP1A2PRMT1ENPP2MEN1
SCHEMBL20735435 0.87 MEN1 (0.53) CYP1A2PRMT1ENPP2MEN1KMT2A
SCHEMBL9626707 0.87 PRMT1 (0.49) CYP1A2PRMT1ENPP2MEN1KMT2A
SCHEMBL9628307 0.87 PRMT1 (0.49) CYP1A2PRMT1ENPP2MEN1KMT2A
SCHEMBL9628300 0.87 PRMT1 (0.49) CYP1A2PRMT1ENPP2MEN1KMT2A
SCHEMBL9626701 0.87 PRMT1 (0.49) CYP1A2PRMT1ENPP2MEN1KMT2A
SCHEMBL8971759 0.85 PRMT1 (0.52) NT5ECYP1A2PRMT1ENPP2MEN1
SCHEMBL10600651 0.85 PHLPP2 (0.51) NT5ECYP1A2PRMT1ENPP2MEN1
SCHEMBL10588141 0.85 ENPP2 (0.49) NT5ECYP1A2PRMT1ENPP2MEN1
SCHEMBL9132078 0.83 ENPP2 (0.54) NT5ECYP1A2ENPP2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4772323-A IMPROVED STORAGE AND EJECTION STABILITY CANON KABUSHIKI KAISHA (JP) 1988-09-20 — — US claimed
US-4703113-A Water-soluble triazine black dyes free from cellulose reactive groups and suitable for use in inks IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-10-27 — — US claimed
US-5118737-A Ink jet printing CANON KABUSHIKI KAISHA (JP) 1992-06-02 — — US disclosed
EP-0176195-B1 WATER-SOLUBLE DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-26 — — EP disclosed
EP-0173476-B1 WATER-SOLUBLE DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-05-29 — — EP disclosed
EP-0219232-B1 WATER-SOLUBLE DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-08-29 — — EP disclosed
EP-0176196-B1 WATER-SOLUBLE DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-04-11 — — EP disclosed
US-4772323-A IMPROVED STORAGE AND EJECTION STABILITY CANON KABUSHIKI KAISHA (JP) 1988-09-20 — — US disclosed
US-4758658-A Water-soluble formazan dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-07-19 — — US disclosed
US-4746733-A INK JET PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-05-24 — — US disclosed
US-4738721-A JET PRINTING CANON KABUSHIKI KAISHA (JP) 1988-04-19 — — US disclosed
US-4735657-A Water-soluble dye in an ink CANON KABUSHIKI KAISHA (JP) 1988-04-05 — — US disclosed
US-4703113-A Water-soluble triazine black dyes free from cellulose reactive groups and suitable for use in inks IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-10-27 — — US disclosed
EP-0219232-A2 Water-soluble dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-22 — — EP disclosed
US-4634555-A INK JET PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-01-06 — — US disclosed
EP-0176195-A2 Water-soluble dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-02 — — EP disclosed
EP-0176196-A2 Water-soluble dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-02 — — EP disclosed
EP-0173476-A2 Water-soluble dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-03-05 — — EP disclosed
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