SCHEMBL9626814

SCHEMBL9626814

CC(=O)Nc1cc(N)ccc1N=Nc1cc(C)c(N=Nc2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 3/20 0.56
▸ CASP6 P55212 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
▸ ATIC P31939 1/20 0.41
▸ NPC1 O15118 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ HTT P42858 2/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ P2RX3 P56373 2/20 0.39
▸ SENP3 Q9H4L4 1/20 0.39
▸ SENP1 Q9P0U3 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38

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
SCHEMBL11750629 0.93 ENPP2 (0.52) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL9626740 0.92 ENPP2 (0.47) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL9626874 0.92 ENPP2 (0.47) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL10351169 0.87 ENPP2 (0.47) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL10351166 0.87 ENPP2 (0.47) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL11424803 0.84 ENPP2 (0.43) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL9136824 0.83 SENP2 (0.56) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL9136821 0.83 SENP2 (0.56) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL4335590 0.81 ENPP2 (0.51) ENPP2CASP6SUMO2SUMO1SENP7
SCHEMBL4335578 0.81 ENPP2 (0.51) ENPP2CASP6SUMO2SUMO1SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-0219232-B1 WATER-SOLUBLE DYE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-08-29 — — 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-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
EP-0176195-A2 Water-soluble dye IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-02 — — EP disclosed
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