SCHEMBL7918008

SCHEMBL7918008

Cc1ccc(S(=O)(=O)O)c(CCN(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.39
HTR7 P34969 2/20 0.37
HTR5A P47898 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTR2A P28223 4/20 0.36
HTR2C P28335 3/20 0.36
HTR1A P08908 2/20 0.36
HTR2B P41595 2/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR1E P28566 1/20 0.36
HTR1F P30939 1/20 0.36
HTR3A P46098 1/20 0.36
SLC47A1 Q96FL8 1/20 0.36
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL644417 0.91 CA12 (0.40) HTR6HTTSMN1; SMN2HTR2AHTR2C
SCHEMBL1180196 0.86 GAA (0.41) GAAHSD17B10TAAR1AMY1A
SCHEMBL30823619 0.86 GAA (0.41) GAAHSD17B10TAAR1AMY1A
SCHEMBL30723203 0.83 GAA (0.39) GAAHSD17B10TAAR1AMY1A
SCHEMBL29975298 0.83 GAA (0.39) HTTGAAHSD17B10TAAR1AMY1A
SCHEMBL816601 0.83 GAA (0.39) GAAHSD17B10TAAR1AMY1A
SCHEMBL5718625 0.83 GAA (0.39) HTTGAAHSD17B10TAAR1AMY1A
SCHEMBL30716894 0.83 AMY1A (0.44) HTTSMN1; SMN2GAAHSD17B10TAAR1
SCHEMBL14991279 0.83 AMY1A (0.44) HTTSMN1; SMN2GAAHSD17B10TAAR1
SCHEMBL3339137 0.81 HSD17B10 (0.39) GAAHSD17B10TAAR1AMY1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0897379-B1 PROCESS FOR CONVERTING A GEMINALLY SUBSTITUTED CYCLOPENTADIENE DSM NV (NL) 2001-10-31 EP disclosed
US-6137019-A Process for converting a geminally substituted cyclopentadiene DSM N.V. (NL) 2000-10-24 US disclosed
US-6124488-A ACTIVE AS CATALYST COMPONENTS, IN PARTICULAR FOR THE POLYMERIZATION OF OLEFINS. DSM N.V. (NL) 2000-09-26 US disclosed
US-6072067-A Cyclopentadiene compound substituted with a hetero atom-containing group DSM N.V. (NL) 2000-06-06 US disclosed
CN-1223666-A Supported catalyst composition and process for the polymerization of olefin monomers DSM NV (NL) 1999-07-21 CN disclosed
EP-0805142-B1 Cyclopentadiene compound substituted with a hetero atom-containing group DSM NV (NL) 1999-03-24 EP disclosed
EP-0900195-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH BRANCHED ALKYL GROUPS DSM N.V. (NL) 1999-03-10 EP disclosed
EP-0897379-A1 PROCESS FOR CONVERTING A GEMINALLY SUBSTITUTED CYCLOPENTADIENE DSM N.V. (NL) 1999-02-24 EP disclosed
EP-0896589-A1 SUPPORTED CATALYST COMPOSITION AND PROCESS FOR THE POLYMERIZATION OF OLEFIN MONOMERS DSM N.V. (NL) 1999-02-17 EP disclosed
WO-1997042162-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH BRANCHED ALKYL GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042228-A1 SUPPORTED CATALYST COMPOSITION AND PROCESS FOR THE POLYMERIZATION OF OLEFIN MONOMERS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042149-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH TERTIARY GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042148-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED WITH CYCLIC GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042164-A1 INDENE SUBSTITUTED WITH A GROUP COMPRISING A HETERO ATOM DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042145-A1 PROCESS FOR CONVERTING A GEMINALLY SUBSTITUTED CYCLOPENTADIENE DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042147-A1 CYCLOPENTADIENE COMPOUND SUBSTITUTED BY ARALKYL GROUPS DSM N.V. (NL) 1997-11-13 WO disclosed
WO-1997042158-A1 SYNTHESIS OF A SUBSTITUTED CYCLOPENTADIENE COMPOUND DSM N.V. (NL) 1997-11-13 WO disclosed
EP-0805142-A1 Cyclopentadiene compound substituted with a hetero atom-containing group DSM N.V. (NL) 1997-11-05 EP disclosed