SCHEMBL3818751

SCHEMBL3818751

CCN(CC)c1cccc(CN(CC(N)=O)c2ccc(Cl)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.46
CNR2 P34972 10/20 0.40
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GHSR Q92847 1/20 0.34
DHFR P00374 1/20 0.34

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
SCHEMBL3824126 0.81 CNR1 (0.41) CNR1CNR2MAPTMEN1GAA
SCHEMBL3818747 0.80 CNR2 (0.47) CNR1CNR2MAPTHTTSMN1; SMN2
SCHEMBL3824123 0.78 CNR1 (0.41) CNR1CNR2MAPTGHSR
SCHEMBL8190064 0.74 CYP3A4 (0.42) CNR1CNR2MAPTMEN1KMT2A
SCHEMBL4735258 0.73 ALDH1A1 (0.52) CNR2MAPTMEN1HTTKMT2A
SCHEMBL4739106 0.73 NPC1 (0.41) CNR1CNR2MAPTMEN1KMT2A
SCHEMBL4738668 0.73 CNR2 (0.40) CNR1CNR2MAPT
SCHEMBL8184199 0.73 MAPK14 (0.44) CNR1CNR2MAPT
SCHEMBL13603931 0.72 NPC1 (0.45) CNR1CNR2MAPTGAAHTT
SCHEMBL4733577 0.72 TLR7 (0.40) CNR1CNR2MAPTSMN1; 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
EP-2091917-A1 ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2009-08-26 EP claimed
WO-2008073934-A1 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed