SCHEMBL5263244

SCHEMBL5263244

COc1ccccc1NCC(O)COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL4843616 0.86
SCHEMBL4841793 0.81 MAPT (0.41) MAPT
Trifluoroacetic Acid SCHEMBL4844154 0.80 ADRB1 (0.39) MEN1KMT2A
SCHEMBL4838763 0.80 MEN1 (0.42) MEN1KMT2A
SCHEMBL4841671 0.80 CYP3A4 (0.43)
SCHEMBL4842323 0.79 ALDH1A1 (0.45) ALDH1A1KMT2A
SCHEMBL4834900 0.79 MAPT (0.45) MAPT
SCHEMBL4833883 0.79
SCHEMBL4843854 0.78 KMT2A (0.48) ALDH1A1MAPTLMNAMEN1HTT
SCHEMBL4842028 0.78 MAPK1 (0.46) MAPTKDM4ELMNAMEN1MAPK1

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