SCHEMBL16975552

SCHEMBL16975552

CCc1c(N)cnn1[C@H]1CCN(C2COC2)C[C@@H]1F

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 6/20 0.44
DYRK1A Q13627 4/20 0.43
KCNH2 Q12809 2/20 0.35
KAT2B Q92831 1/20 0.33
MAP3K12 Q12852 7/20 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
SCHEMBL16985418 1.00 LRRK2 (0.44) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21821365 0.85 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985343 0.85 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985433 0.82 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16975542 0.82 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985357 0.82 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL16985407 0.82 LRRK2 (0.53) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21958372 0.75 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12
SCHEMBL21610987 0.75 LRRK2 (0.55) LRRK2DYRK1AKCNH2KAT2B
SCHEMBL21859053 0.75 LRRK2 (0.46) LRRK2DYRK1AKCNH2KAT2BMAP3K12

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-3099695-A1 COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2016-12-07 EP disclosed
WO-2015113452-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-08-06 WO disclosed