SCHEMBL7510671

SCHEMBL7510671

Cc1[nH]nc(-c2ccc(Cl)cc2)c1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.47
MAP3K14 Q99558 1/20 0.47
BACE1 P56817 1/20 0.47
MAPK1 P28482 4/20 0.45
ALOX12 P18054 3/20 0.45
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
GAA P10253 2/20 0.45
ALOX15 P16050 2/20 0.45
MEN1 O00255 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
KMT2A Q03164 2/20 0.45
GPR55 Q9Y2T6 2/20 0.45
HTT P42858 2/20 0.45
GYS1 P13807 1/20 0.45
SIRT1 Q96EB6 3/20 0.44

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
SCHEMBL28749489 0.87 MAP2K4 (0.51) IKBKBBACE1MAPK1MAPTGAA
SCHEMBL27499014 0.86 MAP2K4 (0.48) IKBKBMAP3K14BACE1MAPK1ALOX12
SCHEMBL27557921 0.84 MAP2K4 (0.43) BACE1MAPK1MAPTGAAMEN1
SCHEMBL6052531 0.84 MAPK1 (0.44) BACE1MAPK1LMNAHPGDMAP2K4
SCHEMBL1528566 0.84 GAA (0.54) MAPK1NPSR1GAAMEN1KMT2A
SCHEMBL8308326 0.83 SIRT1 (0.45) IKBKBMAP3K14GAASIRT1SIRT2
SCHEMBL27578364 0.82 BACE1 (0.55) BACE1MAPK1ALOX12MAPTGAA
SCHEMBL27560751 0.81 MAP2K4 (0.52) IKBKBBACE1MAPK1MAP2K4MAPKAPK2
SCHEMBL27579927 0.81 IDO1 (0.56) BACE1MAPK1SIRT1MAP2K4MAPKAPK2
SCHEMBL27558026 0.77 KDM4E (0.55) BACE1MAPK1ALOX12MAPTNPSR1

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
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP claimed