SCHEMBL11569656

SCHEMBL11569656

CC(=O)CC(=O)c1ccc(C(=O)CC(C)=O)c(N)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
KDM4E B2RXH2 6/20 0.50
HPGD P15428 5/20 0.50
ALDH1A1 P00352 4/20 0.50
GAA P10253 4/20 0.50
HSD17B10 Q99714 2/20 0.50
GLA P06280 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
PRKCI P41743 1/20 0.42
HTT P42858 4/20 0.39
THRB P10828 1/20 0.39
GFER P55789 1/20 0.39
PLEC Q15149 1/20 0.39
CREBBP Q92793 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ABL1 P00519 1/20 0.38

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
SCHEMBL27450524 0.90 ALDH1A1 (0.47) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL8960208 0.82 MAPT (0.61) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL8281122 0.81 HDAC1 (0.41) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL28632380 0.79 MAPT (0.43) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL10920479 0.78 ALDH1A1 (0.65) MAPTALDH1A1GAAHSD17B10RAB9A
SCHEMBL5518380 0.77 KDM4E (0.43) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL2003577 0.76 KMT2A (0.52) MAPTKDM4EHPGDALDH1A1HSD17B10
SCHEMBL10966054 0.76 ALDH1A1 (0.55) MAPTKDM4EHPGDALDH1A1GAA
SCHEMBL11150129 0.75 MEN1 (0.50) MAPTKDM4EHPGDALDH1A1RAB9A
SCHEMBL20447579 0.74 GSK3B (0.48) MAPTKDM4EHPGDALDH1A1GAA

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-0004611-A1 Process for the preparation of acetoacetylaryl amides CIBA-GEIGY AG (CH) 1979-10-17 EP disclosed