SCHEMBL8229306

SCHEMBL8229306

COc1ccc(-n2cc(-c3ccccc3)nc2N)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
KDM4E B2RXH2 5/20 0.48
KMT2A Q03164 4/20 0.48
MAPK1 P28482 4/20 0.48
HSD17B10 Q99714 4/20 0.48
MEN1 O00255 3/20 0.48
HPGD P15428 3/20 0.48
TSHR P16473 3/20 0.48
USP2 O75604 2/20 0.48
HTT P42858 1/20 0.48
ATM Q13315 1/20 0.48
AGTR1 P30556 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 6/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.46
ADORA1 P30542 3/20 0.45
ADORA2A P29274 2/20 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
SCHEMBL5345839 0.77 MAPT (0.61) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL8034913 0.76 TLR8 (0.56) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL8235818 0.74 MAPT (0.54) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL24461941 0.73 MAPT (0.49) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL5319270 0.72 MAPT (0.47) ALDH1A1KDM4EKMT2AHSD17B10MEN1
SCHEMBL25383681 0.72 MAPT (0.47) ALDH1A1KDM4EKMT2AMAPK1MEN1
SCHEMBL8235194 0.71 MAPT (0.49) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL5320946 0.70 ALDH1A1 (0.51) ALDH1A1KDM4EKMT2AMEN1L3MBTL1
SCHEMBL5347074 0.69 MAPT (0.50) ALDH1A1KDM4EKMT2AHTTMAPT
SCHEMBL4750651 0.69 ALDH1A1 (0.43) ALDH1A1KDM4EKMT2AMAPK1HSD17B10

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-2007082666-A1 ACYLAMINOIMIDAZOLES BAYER HEALTHCARE AG (DE) 2007-07-26 WO disclosed