SCHEMBL20569455

SCHEMBL20569455

CCc1nccn1CCCc1ccc(Cl)cc1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.49
NMT1 P30419 1/20 0.40
TLR8 Q9NR97 2/20 0.40
ALPG P10696 1/20 0.39
PLAA Q9Y263 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HSP90B1 P14625 1/20 0.39
BRD4 O60885 1/20 0.39

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
SCHEMBL20570323 0.85 KCNH2 (0.49) KCNH2HSP90AA1HSP90B1
SCHEMBL8446096 0.82 SMN1; SMN2 (0.51) KCNH2
SCHEMBL20569246 0.82 TLR8 (0.53) KCNH2TLR8BRD4
SCHEMBL20572275 0.78 KCNH2 (0.50) KCNH2NMT1
SCHEMBL20569778 0.78 TLR8 (0.55) KCNH2TLR8
SCHEMBL20569140 0.77 FLT1 (0.37)
SCHEMBL20569454 0.76 KCNH2 (0.40) KCNH2
SCHEMBL20569159 0.76 KCNH2 (0.40) KCNH2BRD4
SCHEMBL20570174 0.76 KCNH2 (0.40) KCNH2
SCHEMBL20569838 0.76 KCNH2 (0.40) KCNH2NMT1BRD4

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
WO-2018216822-A1 NOVEL IMIDAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-11-29 WO disclosed