SCHEMBL6526630

SCHEMBL6526630

COc1ccc2nccc(C(O)CN3CCC(NCc4cc5cc(Br)ccc5[nH]4)CC3)c2c1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 12/20 0.78
KCNH2 Q12809 6/20 0.60

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
SCHEMBL4269347 1.00 SLC2A1 (0.78) SLC2A1KCNH2
SCHEMBL27577361 0.90 SLC2A1 (0.77) SLC2A1KCNH2
SCHEMBL4269307 0.90 SLC2A1 (0.77) SLC2A1KCNH2
SCHEMBL13857004 0.86 SLC2A1 (0.71) SLC2A1KCNH2
SCHEMBL4279724 0.85 SLC2A1 (0.75) SLC2A1KCNH2
SCHEMBL7170541 0.85 SLC2A1 (0.75) SLC2A1KCNH2
SCHEMBL5775467 0.85 SLC2A1 (0.58) SLC2A1KCNH2
SCHEMBL4279211 0.84 SLC2A1 (0.74) SLC2A1KCNH2
SCHEMBL4278299 0.82 SLC2A1 (0.99) SLC2A1KCNH2
Hydrochloric Acid SCHEMBL4284849 0.81 SLC2A1 (1.00) SLC2A1KCNH2

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-6962917-B2 Aminopiperidine quinolines and their azaisosteric analogues with antibacterical activity SMITHKLINE BEECHAM P.L.C. (GB) 2005-11-08 US disclosed