SCHEMBL9511100

SCHEMBL9511100

O=S(=O)(NCCCCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.60
DRD2 P14416 7/20 0.58
HTR1A P08908 2/20 0.58
HTR2A P28223 1/20 0.58
HTR6 P50406 1/20 0.58
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
DRD3 P35462 6/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ADRA1B P35368 1/20 0.51

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
SCHEMBL9512269 1.00 HTR7 (0.60) HTR7DRD2HTR1AHTR2AHTR6
SCHEMBL9511082 0.95 HTR7 (0.67) HTR7DRD2HTR1AHTR2AHTR6
SCHEMBL9512303 0.87 KMT2A (0.62) HTR7DRD2HTR2AHTR6ALDH1A1
SCHEMBL9510088 0.87 HTR7 (0.57) HTR7DRD2HTR1AHTR2AALDH1A1
SCHEMBL12672472 0.83 HTR7 (0.83) HTR7DRD2HTR1AHTR2AHTR6
SCHEMBL10826588 0.81 DRD2 (0.54) DRD2HTR2AALDH1A1LMNADRD3
SCHEMBL7389546 0.81 ALDH1A1 (0.64) HTR7DRD2HTR1AHTR2AHTR6
SCHEMBL7391177 0.79 HTR7 (0.65) HTR7DRD2HTR1AHTR2AHTR6
SCHEMBL7773443 0.79 DRD2 (0.57) DRD2ALDH1A1LMNADRD3L3MBTL1
SCHEMBL12373318 0.78 DRD3 (0.59) DRD2HTR2ADRD3ADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0330065-B1 Sulfonamide compounds KOWA CO (JP) 1993-11-10 EP claimed
US-4948892-A Sulfonamid compound useful for treating cardiovascular disorders KOWA COMP., LTD. (JP) 1990-08-14 US claimed
EP-0330065-A1 Sulfonamide compounds KOWA COMPANY, LTD. (JP) 1989-08-30 EP claimed