SCHEMBL7798697

SCHEMBL7798697

COc1cc(NS(=O)(=O)c2ccccc2)c(O)cc1NC(=O)C[N+]1(C)CCN(C)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.44
MCOLN2 Q8IZK6 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
MCOLN1 Q9GZU1 1/20 0.43
HTR6 P50406 1/20 0.43
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
LMNA P02545 5/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 3/20 0.42
RECQL P46063 1/20 0.42
BRD1 O95696 2/20 0.41
BRPF1 P55201 2/20 0.41
BRPF3 Q9ULD4 2/20 0.41
MAPK1 P28482 1/20 0.41
HTR2A P28223 1/20 0.41

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 SCHEMBL7158144 0.99 TRIM24 (0.43) TRIM24MCOLN2MCOLN3MCOLN1HTR6
SCHEMBL7798700 0.87 KMT2A (0.43) HTR6KMT2AMEN1LMNAMAPT
SCHEMBL6575877 0.87 MEN1 (0.42) KMT2AMEN1LMNAMAPTL3MBTL1
Hydrochloric Acid SCHEMBL7156926 0.86 KMT2A (0.42) HTR6KMT2AMEN1LMNAMAPT
Hydrochloric Acid SCHEMBL6573313 0.86 ALDH1A1 (0.41) KMT2AMEN1LMNAMAPTL3MBTL1
SCHEMBL7798719 0.83 MCL1 (0.48) HTR6KMT2AMEN1LMNAMAPT
Hydrochloric Acid SCHEMBL7158538 0.82 MCL1 (0.48) HTR6KMT2AMEN1LMNAMAPT
SCHEMBL6943658 0.81 KMT2A (0.40) KMT2AMEN1LMNAMAPTL3MBTL1
SCHEMBL6943626 0.81 GAA (0.43) KMT2AMEN1LMNAMAPTL3MBTL1
SCHEMBL6939899 0.81 KMT2A (0.40) KMT2AMEN1LMNAMAPTL3MBTL1

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 4 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-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