SCHEMBL5834147

SCHEMBL5834147

COCC[C@H](N)[C@H]1CN(c2cc(F)c3c(=O)n(N)c(=O)n(C4CC4)c3c2C)C[C@H]1F

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.31

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
SCHEMBL1383035 0.85 KCNH2 (0.38) KCNH2
SCHEMBL1381731 0.85 KCNH2 (0.38) KCNH2
SCHEMBL4514823 0.84
SCHEMBL1382143 0.84
SCHEMBL1381707 0.81 KCNH2 (0.37) KCNH2
SCHEMBL4523242 0.81 KCNH2 (0.37) KCNH2
SCHEMBL4511264 0.79 KCNH2 (0.38) KCNH2
SCHEMBL4516904 0.79 KCNH2 (0.35) KCNH2
SCHEMBL4516080 0.79 KCNH2 (0.38) KCNH2
SCHEMBL4717107 0.79 KCNH2 (0.35) 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
US-7094780-B1 3-aminoquinazolin-2,4-dione antibacterial agents WARNER LAMBERT COMPANY LLC (US) 2006-08-22 US claimed