SCHEMBL8575877

SCHEMBL8575877

Cc1c(N2CCC(CF)(NC(=O)OC(C)(C)C)C2)c(F)cn2c(=O)c(C(=O)O)cc(C3CC3)c12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.36
KCNH2 Q12809 3/20 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
SCHEMBL8575667 0.92 ADRB2 (0.31) SCN5AKCNH2
SCHEMBL8569701 0.82 SCN5A (0.36) SCN5AKCNH2
SCHEMBL8565903 0.82 SCN5A (0.44) SCN5AKCNH2
Hydrochloric Acid SCHEMBL8573819 0.81 SCN5A (0.44) SCN5AKCNH2
SCHEMBL8571984 0.80 SCN5A (0.39) SCN5AKCNH2
SCHEMBL7501829 0.80 SCN5A (0.38) SCN5AKCNH2
SCHEMBL7506081 0.80 SCN5A (0.38) SCN5AKCNH2
SCHEMBL14497198 0.79 ACACB (0.39) SCN5AKCNH2
SCHEMBL8893288 0.78 SCN5A (0.42) SCN5AKCNH2
Hydrochloric Acid SCHEMBL9055075 0.78 SCN5A (0.43) SCN5AKCNH2

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-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 WO disclosed