SCHEMBL4776915

SCHEMBL4776915

O=c1cnc2ccc(F)cc2n1CCN1CC[CH]CC1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.47

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
SCHEMBL27773493 0.90 KCNH2 (0.56) KCNH2
SCHEMBL4777392 0.85 KCNH2 (0.38) KCNH2
SCHEMBL706071 0.84 KCNH2 (0.52) KCNH2
Hydrochloric Acid SCHEMBL3860901 0.83 KCNH2 (0.51) KCNH2
SCHEMBL27773476 0.80 KCNH2 (0.50) KCNH2
SCHEMBL27878080 0.80 KCNH2 (0.43) KCNH2
SCHEMBL14020817 0.80 KCNH2 (0.58) KCNH2
SCHEMBL27773506 0.79 KCNH2 (0.48) KCNH2
SCHEMBL924650 0.79 KCNH2 (0.52) KCNH2
SCHEMBL13264362 0.79 KCNH2 (0.46) 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-1992628-A1 Derivatives and analogs of N-ethylquinolones and N-ethylazaquinolones GLAXO GROUP LIMITED (GB) 2008-11-19 EP disclosed