SCHEMBL9759926

SCHEMBL9759926

CN(CCOc1ccc(NS(C)(=O)=O)cc1)c1ccncc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.58
CACNA1F O60840 1/20 0.58
CHRM2 P08172 1/20 0.58
ACHE P22303 1/20 0.58
AGTR1 P30556 1/20 0.58
DRD3 P35462 1/20 0.58
CACNA1D Q01668 1/20 0.58
CACNA1S Q13698 1/20 0.58
CACNA1C Q13936 1/20 0.58
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
F2 P00734 2/20 0.50
PRSS2 P07478 1/20 0.46
CTRC Q99895 1/20 0.46
AR P10275 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LTA4H P09960 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL9760114 0.85 NR3C2 (0.51) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL9847950 0.78 KCNH2 (0.48) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL7861253 0.77 KCNH2 (0.78) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL9759941 0.76 F2 (0.48) NPC1RAB9AF2PRSS2CTRC
SCHEMBL10425925 0.75 NPC1 (0.66) KCNH2CACNA1FCHRM2ACHEAGTR1
Dofetilide SCHEMBL6102734 0.74 KCNH2 (1.00) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL9760110 0.74 KCNH2 (0.56) KCNH2F2POLB
Dofetilide SCHEMBL16135 0.74 KCNH2 (1.00) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL7854083 0.74 KCNH2 (0.72) KCNH2CACNA1FCHRM2ACHEAGTR1
SCHEMBL1284402 0.73 F2 (0.47) F2PRSS2CTRCSMN1; SMN2LMNA

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-5057528-A AMINO-PYRIDINE COMPOUNDS USEFUL AS ANTI-ARRHYTHMIC AGENTS PFIZER INC. (US) 1991-10-15 US disclosed
US-4968704-A PROLONG DURATION OF ACTION POTENTIAL IN CARDIAC MUSCLE AND CONDUCTING TISSUE PFIZER INC. (US) 1990-11-06 US disclosed
EP-0359389-A1 Antiarrhythmic agents Pfizer Limited (GB) 1990-03-21 EP disclosed