SCHEMBL8557731

SCHEMBL8557731

CN1Cc2ccccc2C(c2ccccc2Cl)N=C1CCc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.74
HRH4 Q9H3N8 1/20 0.36
MAOB P27338 1/20 0.36
SLC18A2 Q05940 1/20 0.35
GAA P10253 1/20 0.34

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
SCHEMBL8554712 0.85 KCNH2 (1.00) KCNH2
SCHEMBL8556398 0.85 KCNH2 (1.00) KCNH2
SCHEMBL8555810 0.85 KCNH2 (1.00) KCNH2
SCHEMBL8557736 0.85 KCNH2 (0.83) KCNH2
SCHEMBL8554225 0.82 KCNH2 (0.83) KCNH2
SCHEMBL8553978 0.80 KCNH2 (0.83) KCNH2
SCHEMBL8864698 0.78 KCNH2 (0.83) KCNH2MAOBGAA
SCHEMBL8553316 0.78 KCNH2 (0.83) KCNH2MAOB
Hydrochloric Acid SCHEMBL8864716 0.77 KCNH2 (0.81) KCNH2MAOBGAA
SCHEMBL9255295 0.76 KCNH2 (0.81) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0475527-B1 Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents SANOFI SA (FR) 1998-02-25 EP claimed