SCHEMBL4734183

SCHEMBL4734183

[CH2]c1ccc(N(CC)CC)nc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.60
AOC3 Q16853 1/20 0.41
HCAR3 P49019 1/20 0.39
MYC P01106 14/20 0.38
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL179288 0.77 GBA1 (0.62) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL10622006 0.77 GBA1 (0.62) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL2307310 0.76 APP (0.40) GBA1SMN1; SMN2
SCHEMBL1432871 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL8430068 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCSMN1; SMN2
SCHEMBL17316578 0.75 GBA1 (1.00) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL7096589 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL2793295 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL17274025 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCKMT2A
SCHEMBL30175373 0.75 GBA1 (0.60) GBA1AOC3HCAR3MYCSMN1; SMN2

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
WO-2008073461-A2 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed
CN-101379041-A Tricyclic N-heteroaryl-amide derivatives containing benzimidazole structural units, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2009-03-04 CN disclosed