SCHEMBL6573637

SCHEMBL6573637

COc1cc(NS(C)(=O)=O)c(O)cc1NC(=O)C[n+]1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.55
ALDH1A1 P00352 7/20 0.52
KMT2A Q03164 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 1/20 0.51
ATM Q13315 1/20 0.46
HSP90AA1 P07900 1/20 0.44
HTT P42858 1/20 0.42
MAPK1 P28482 2/20 0.41
MAPT P10636 2/20 0.41
AHR P35869 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.40
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.39
BACE1 P56817 1/20 0.39

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
Hydrochloric Acid SCHEMBL6574257 0.99 POLB (0.57) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL7805078 0.87 POLB (0.57) POLBALDH1A1KMT2ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL7154666 0.86 POLB (0.58) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL6943678 0.85 POLB (0.58) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL6940472 0.85 POLB (0.58) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL6941219 0.85 POLB (0.58) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL6943705 0.85 POLB (0.58) POLBALDH1A1KMT2ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL6941908 0.84 POLB (0.60) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL6573931 0.84 L3MBTL1 (0.49) POLBALDH1A1KMT2AMEN1HSP90AA1
Hydrochloric Acid SCHEMBL6940856 0.84 POLB (0.60) POLBALDH1A1KMT2ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066264-A2 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP claimed
WO-2000042971-A2 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO claimed
EP-1066264-B1 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS OREAL (FR) 2004-11-17 EP disclosed
EP-1066264-A2 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP disclosed
WO-2000042971-A2 NOVEL CATIONIC 2-SULPHONYLAMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING, COMPOSITIONS CONTAINING THEM AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO disclosed