SCHEMBL9624564

SCHEMBL9624564

CC(=O)c1ccc(NS(C)(=O)=O)c(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.48
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NEU3 Q9UQ49 1/20 0.44
PRKCI P41743 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
AKR1C3 P42330 4/20 0.42
AKR1C2 P52895 4/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
EP300 Q09472 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
HTT P42858 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
SCHEMBL6746720 0.87 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL1474880 0.81 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL5674438 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL9537164 0.80 PRKCI (0.65) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL9624571 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL912924 0.79 PRKCI (0.62) SMN1; SMN2ALDH1A1HSD17B10PRKCICA1
SCHEMBL7110796 0.79 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL1474531 0.79 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL9535456 0.79 AKR1C3 (0.60) SMN1; SMN2ALDH1A1AKR1C3AKR1C2
SCHEMBL966589 0.78 ADRB3 (0.58) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10

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
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
CN-1056100-A The preparation method of alkane sulfonyl aniline derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1991-11-13 CN disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed