SCHEMBL6580203

SCHEMBL6580203

Cc1ccc(S(=O)(=O)c2ccc3c(c2)c(CCOC(N)=O)cn3C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NQO2 P16083 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
ADRB2 P07550 1/20 0.39
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.39
SPR P35270 1/20 0.38
CDK2 P24941 1/20 0.38
KDM4E B2RXH2 1/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
HTR6 P50406 1/20 0.37
PCSK9 Q8NBP7 1/20 0.37

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
SCHEMBL6579474 0.83 ADRB2 (0.53) GAATP53MEN1KMT2AADRB2
Hydrochloric Acid SCHEMBL6577815 0.82 ADRB2 (0.52) GAATP53MEN1KMT2AADRB2
SCHEMBL7163717 0.78 HTR6 (0.43) GAATP53MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL6577292 0.77 HTR6 (0.43) GAATP53MEN1KMT2AALDH1A1
SCHEMBL6577287 0.76 NQO2 (0.47) GAATP53MEN1KMT2ANQO2
SCHEMBL7166453 0.76 HTR6 (0.42) GAATP53SMN1; SMN2MEN1KMT2A
SCHEMBL7170079 0.73 NQO2 (0.50) GAATP53MEN1KMT2AALDH1A1
SCHEMBL29169604 0.72 HTR6 (0.69) KDM4EHTR6HTR1D
Hydrochloric Acid SCHEMBL6580166 0.72 HTR2A (0.56) ADRB2HTR6HTR1D
SCHEMBL6579630 0.68 NQO2 (0.47) MEN1KMT2ANQO2MTNR1AMTNR1B

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-1411925-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2004-04-28 EP claimed
WO-2003011284-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2003-02-13 WO claimed
EP-1411925-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2004-04-28 EP disclosed
WO-2003011284-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2003-02-13 WO disclosed