SCHEMBL7097625

SCHEMBL7097625

O=S(=O)(CCCCCCN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1)NC1CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 12/20 0.57
▸ DRD2 P14416 10/20 0.57
▸ HRH1 P35367 4/20 0.52
▸ KCNH2 Q12809 3/20 0.52
▸ HRH2 P25021 2/20 0.52
▸ HTR2A P28223 2/20 0.52
▸ HTR2B P41595 2/20 0.52
▸ USP2 O75604 2/20 0.52
▸ SLC6A2 P23975 2/20 0.52
▸ SLC6A4 P31645 2/20 0.52
▸ SLC6A3 Q01959 2/20 0.52
▸ TEK Q02763 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ CHRM2 P08172 2/20 0.51
▸ ADRA2A P08913 2/20 0.51
▸ ADRA1A P35348 2/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ ADRA2B P18089 1/20 0.51
▸ ADRA2C P18825 1/20 0.51
▸ DRD4 P21917 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
SCHEMBL7099285 1.00 DRD3 (0.57) DRD3DRD2HRH1KCNH2HRH2
SCHEMBL7097660 1.00 DRD3 (0.57) DRD3DRD2HRH1KCNH2HRH2
SCHEMBL7103672 1.00 DRD3 (0.57) DRD3DRD2HRH1KCNH2HRH2
Hydrochloric Acid SCHEMBL7101884 0.99 DRD3 (0.56) DRD3DRD2HRH1KCNH2HRH2
Hydrochloric Acid SCHEMBL7097383 0.99 DRD3 (0.56) DRD3DRD2HRH1KCNH2HRH2
SCHEMBL7099299 0.96 DRD3 (0.50) DRD3DRD2HRH1KCNH2HRH2
SCHEMBL7098300 0.91 DRD2 (0.49) DRD3DRD2HRH1KCNH2HRH2
Bromide SCHEMBL7100449 0.90 DRD2 (0.49) DRD3DRD2HRH1KCNH2HRH2
Hydrochloric Acid SCHEMBL7101513 0.90 DRD2 (0.49) DRD3DRD2HRH1HTR7HTR1A
Hydrochloric Acid SCHEMBL7098258 0.90 DRD2 (0.49) DRD3DRD2HRH1HTR7HTR1A

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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