SCHEMBL9624937

SCHEMBL9624937

CCCCN(CCCC)CC(=O)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
KCNH2 Q12809 3/20 0.51
CHRM2 P08172 2/20 0.51
SLC6A4 P31645 2/20 0.51
DRD3 P35462 2/20 0.51
CACNA1F O60840 1/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
CHRM3 P20309 1/20 0.51
HTR2A P28223 1/20 0.51
CACNA1D Q01668 1/20 0.51
CACNA1S Q13698 1/20 0.51
CACNA1C Q13936 1/20 0.51
PTGS2 P35354 3/20 0.50
THRA P10827 3/20 0.50
HPGD P15428 1/20 0.50
RECQL P46063 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
HDAC3 O15379 1/20 0.49

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
SCHEMBL9624837 0.90 CHRM2 (0.62) KDM4EKCNH2CHRM2SLC6A4DRD3
Hydrochloric Acid SCHEMBL9624737 0.89 CACNA1F (0.61) KDM4EKCNH2CHRM2SLC6A4DRD3
SCHEMBL9625076 0.88 THRA (0.58) KDM4EKCNH2CHRM2SLC6A4DRD3
SCHEMBL9625720 0.81 CACNA1F (0.64) KDM4EKCNH2CHRM2SLC6A4DRD3
SCHEMBL10643227 0.80 KDM4E (0.55) KDM4EKCNH2CHRM2SLC6A4DRD3
Hydrochloric Acid SCHEMBL9625546 0.80 CACNA1F (0.63) KDM4EKCNH2CHRM2SLC6A4DRD3
SCHEMBL10642843 0.78 KCNH2 (0.49) KDM4EKCNH2CHRM2SLC6A4DRD3
SCHEMBL1474479 0.77 HPGD (0.63) KDM4EPTGS2HPGDRECQLHDAC3
SCHEMBL11754505 0.76 GSK3B (0.52) KDM4EKCNH2CHRM2DRD3THRA
SCHEMBL11749642 0.76 KDM4E (0.56) KDM4ETHRAHPGDALDH1A1MEN1

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
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed