SCHEMBL22326109

SCHEMBL22326109

Brc1ccc2[nH]cnc2c1Oc1ccccc1.Nc1ccc(Br)c(Oc2ccccc2)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
PRNP P04156 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DPP4 P27487 1/20 0.36
MAPK8 P45983 1/20 0.33
MMP12 P39900 1/20 0.33
RHEB Q15382 2/20 0.32
APAF1 O14727 1/20 0.32
TDP2 O95551 1/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
BRD4 O60885 2/20 0.32
PARP1 P09874 1/20 0.31

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
SCHEMBL22326023 0.89 MAPT (0.44) MEN1ALDH1A1MAPTKMT2APRNP
SCHEMBL22325979 0.81 MAOA (0.42) MEN1ALDH1A1MAPTKMT2AHTT
SCHEMBL22325947 0.78 PARP1 (0.33) MAPTKMT2AMAPK8PARP1DRD2
SCHEMBL25386569 0.75 DPP4 (0.48) MEN1ALDH1A1MAPTKMT2APRNP
SCHEMBL22325975 0.72
SCHEMBL15893400 0.69 ALDH1A1 (0.42) MEN1ALDH1A1MAPTKMT2APRNP
SCHEMBL22325766 0.68 MEN1 (0.40) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL22326024 0.66 MAOB (0.44) MEN1ALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL6142572 0.66 MMP12 (0.41) MEN1ALDH1A1MAPTKMT2APRNP
SCHEMBL22325738 0.66 MAOA (0.47) MEN1ALDH1A1MAPTKMT2AHPGD

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
WO-2020162471-A1 PYRIDONE DERIVATIVE マルホ株式会社 2020-08-13 WO disclosed