SCHEMBL7100414

SCHEMBL7100414

O=S(=O)(CCCCCCN1CCN(Cc2ccccc2-c2cccc(Cl)c2)CC1)NC1CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 7/20 0.47
▸ HTR1A P08908 5/20 0.47
▸ DRD2 P14416 2/20 0.44
▸ HTR6 P50406 2/20 0.44
▸ CHRM1 P11229 2/20 0.41
▸ CHRM3 P20309 2/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ HTR2A P28223 1/20 0.40

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
Bromide SCHEMBL7100454 0.99 HTR7 (0.47) HTR7HTR1ADRD2HTR6CHRM1
Hydrochloric Acid SCHEMBL7101891 0.99 HTR7 (0.47) HTR7HTR1ADRD2HTR6CHRM1
Hydrochloric Acid SCHEMBL7101517 0.99 HTR7 (0.47) HTR7HTR1ADRD2HTR6CHRM1
Oxalic Acid SCHEMBL7097833 0.96 HTR7 (0.46) HTR7HTR1ADRD2HTR6CHRM1
Fumaric Acid SCHEMBL7957765 0.93 HTR7 (0.44) HTR7HTR1ADRD2HTR6CHRM1
SCHEMBL7099289 0.89 BCL2 (0.48) HTR7
SCHEMBL7097626 0.89 BCL2 (0.48) HTR7
SCHEMBL7097662 0.89 BCL2 (0.48) HTR7
SCHEMBL7103677 0.89 BCL2 (0.48) HTR7
Hydrochloric Acid SCHEMBL7097386 0.89 BCL2 (0.47) HTR7

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-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 — — EP disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 — — US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 — — EP disclosed
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