SCHEMBL9538401

SCHEMBL9538401

CC(=O)c1ccc(NS(C)(=O)=O)c(Sc2ccc(Cl)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HPGD P15428 4/20 0.44
LMNA P02545 3/20 0.44
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 1/20 0.44
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 2/20 0.42
CYP2C9 P11712 1/20 0.41
AKR1B1 P15121 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
PTGS2 P35354 4/20 0.40
PTGS1 P23219 1/20 0.40
BLM P54132 1/20 0.40
NOD2 Q9HC29 1/20 0.40
ATM Q13315 1/20 0.39
TP53 P04637 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
SCHEMBL9535010 0.87 PTGS2 (0.54) ALDH1A1HPGDMAPTL3MBTL1NPSR1
SCHEMBL9538398 0.85 PTGS1 (0.55) ALDH1A1HPGDMAPTAKR1C3AKR1C2
SCHEMBL28401357 0.81 PTGS2 (0.52) ALDH1A1MAPTKMT2ACYP2C9AKR1B1
SCHEMBL9539520 0.81 ALDH1A1 (0.45) ALDH1A1HPGDMAPTL3MBTL1KDM4E
SCHEMBL28889111 0.79 PTGS2 (0.55) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL8100934 0.78 CA2 (0.44) PTGS2PTGS1
SCHEMBL9535435 0.78 ALDH1A1 (0.43) ALDH1A1HPGDMAPTNPSR1KDM4E
SCHEMBL9624571 0.76 SMN1; SMN2 (0.53) ALDH1A1HPGDKDM4EAKR1C3AKR1C2
SCHEMBL9535213 0.76 PTGS2 (0.56) ALDH1A1HPGDMAPTKDM4ESMN1; SMN2
SCHEMBL9536561 0.75 MAPT (0.57) ALDH1A1HPGDLMNAMAPTL3MBTL1

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-0292979-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-21 EP disclosed
CN-1019388-B Process for preparing N-alkylsulfonamide derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1992-12-09 CN disclosed
CN-88103277-A Novel N-alkane sulfonyl aniline derivatives and preparation method thereof and the pharmaceutical composition that comprises this material 1988-12-07 CN disclosed
EP-0292979-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-30 EP disclosed