SCHEMBL6586389

SCHEMBL6586389

O=C1c2ccc3ccccc3c2C(=O)N1CCS(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.43
HEXA P06865 1/20 0.37
HEXB P07686 1/20 0.37
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
PDE10A Q9Y233 2/20 0.36
CYP1A2 P05177 1/20 0.36
NSD2 O96028 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
CASP3 P42574 1/20 0.35
CES1 P23141 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
WDR5 P61964 1/20 0.34

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
SCHEMBL4997819 0.82 HEXA (0.55) DNMT1HEXAHEXBALDH1A1SMN1; SMN2
SCHEMBL4187946 0.80 KDM4E (0.51) DNMT1HEXAHEXBALDH1A1SMN1; SMN2
SCHEMBL10396735 0.80 BCHE (0.44) DNMT1HEXAHEXBALDH1A1SMN1; SMN2
SCHEMBL11877346 0.79 DNMT1 (0.46) DNMT1HEXAHEXBALDH1A1SMN1; SMN2
SCHEMBL4997234 0.79 MEN1 (0.49) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL496740 0.78 GLS (0.53) ALDH1A1SMN1; SMN2KMT2AMAPTRAB9A
SCHEMBL6584603 0.78 PGAM1 (0.37) ALDH1A1MEN1KMT2AMAPTGLS
SCHEMBL4448748 0.77 DNMT1 (0.41) DNMT1HEXAHEXBSMN1; SMN2MAPT
Potassium SCHEMBL6284198 0.77 GLS (0.52) ALDH1A1SMN1; SMN2KMT2AMAPTRAB9A
SCHEMBL6284185 0.77 GLS (0.52) ALDH1A1SMN1; SMN2KMT2AMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1010731-B1 Process for the preparation of highly chromatic perylene pigments SUN CHEMICAL CORP (US) 2004-11-03 EP claimed
EP-1217043-A2 Process for the preparation of perylene pigments Bayer Corporation (US) 2002-06-26 EP claimed
US-6403797-B1 REACTING MIXTURE COMPRISING PERYLENE TETRACARBOXYLIC COMPOUND, AMPHOTERIC SURFACTANT, AND EXCESS AMMONIA OR PRIMARY AMINE TO FORM INTERMEDIATE, HEATING IN PRESENCE OF NON-PIGMENTARY CYCLIC ANHYDRIDE OR IMIDE, COLLECTING PIGMENT BAYER CORPORATION 2002-06-11 US claimed
EP-1010731-A2 Process for the preparation of highly chromatic perylene pigments Bayer Corporation (US) 2000-06-21 EP claimed
US-6015458-A Process for the preparation of highly chromatic perylene pigments BAYER CORPORATION (US) 2000-01-18 US claimed
EP-1010731-B1 Process for the preparation of highly chromatic perylene pigments SUN CHEMICAL CORP (US) 2004-11-03 EP disclosed
EP-1217043-A2 Process for the preparation of perylene pigments Bayer Corporation (US) 2002-06-26 EP disclosed
US-6403797-B1 REACTING MIXTURE COMPRISING PERYLENE TETRACARBOXYLIC COMPOUND, AMPHOTERIC SURFACTANT, AND EXCESS AMMONIA OR PRIMARY AMINE TO FORM INTERMEDIATE, HEATING IN PRESENCE OF NON-PIGMENTARY CYCLIC ANHYDRIDE OR IMIDE, COLLECTING PIGMENT BAYER CORPORATION 2002-06-11 US disclosed
EP-1010731-A2 Process for the preparation of highly chromatic perylene pigments Bayer Corporation (US) 2000-06-21 EP disclosed
US-6015458-A Process for the preparation of highly chromatic perylene pigments BAYER CORPORATION (US) 2000-01-18 US disclosed