SCHEMBL3633118

SCHEMBL3633118

COc1ccc2nccc(N(C[C@H]3COC(=O)N3c3ccc4c(c3)NC(=O)CS4)C3CNC3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.33
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL3629665 0.95 KCNH2 (0.32) KCNH2
SCHEMBL3667598 0.84 KCNH2 (0.34) KCNH2
SCHEMBL3634412 0.82 KCNH2 (0.36) KCNH2
SCHEMBL3723582 0.82 KCNH2 (0.36) KCNH2
SCHEMBL3634497 0.82 KCNH2 (0.34) KCNH2HPGD
SCHEMBL3662191 0.80 KCNH2 (0.39) KCNH2
SCHEMBL3630490 0.80 KCNH2 (0.37) KCNH2
SCHEMBL3633217 0.79 KCNH2 (0.35) KCNH2
SCHEMBL3659151 0.79 KCNH2 (0.37) KCNH2
SCHEMBL3628040 0.79 KCNH2 (0.36) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2144910-A2 OXAZOLIDINONE ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2010-01-20 EP disclosed
WO-2008126034-A2 OXAZOLIDINONE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2008-10-23 WO disclosed