SCHEMBL5259755

SCHEMBL5259755

OC(COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1)CN1CCN(c2ccccn2)CC1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.63
HSD17B10 Q99714 3/20 0.63
NPSR1 Q6W5P4 2/20 0.63
MAPK1 P28482 2/20 0.63
HTT P42858 2/20 0.63
USP2 O75604 1/20 0.63
MAPT P10636 5/20 0.54
DRD2 P14416 1/20 0.50
DRD3 P35462 1/20 0.50
LMNA P02545 5/20 0.49
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALOX15 P16050 2/20 0.49
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.45
IGF1R P08069 1/20 0.45

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
Trifluoroacetic Acid SCHEMBL5258064 0.93 KDM4E (0.55) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL4838091 0.90 NPSR1 (0.49) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL5257212 0.89 MAPT (0.54) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL4840594 0.86 NPSR1 (0.46) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL4835082 0.86 NPSR1 (0.45) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL4839497 0.86 NPSR1 (0.54) KDM4EHSD17B10NPSR1MAPK1USP2
SCHEMBL4834088 0.85 DRD3 (0.63) DRD2DRD3
SCHEMBL4839716 0.85 ATM (0.54) KDM4EHSD17B10NPSR1ALDH1A1KMT2A
SCHEMBL4843775 0.85 HSP90AB1 (0.57) KDM4EHSD17B10NPSR1MAPK1HTT
SCHEMBL4843946 0.85 ALDH1A1 (0.54) KDM4EHSD17B10NPSR1MAPK1HTT

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-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP claimed