SCHEMBL8960208

SCHEMBL8960208

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.61
TDP1 Q9NUW8 2/20 0.61
PRKCI P41743 1/20 0.42
ALDH1A1 P00352 4/20 0.41
CASP1 P29466 2/20 0.41
GAA P10253 6/20 0.39
KDM4E B2RXH2 5/20 0.39
HPGD P15428 4/20 0.39
THRB P10828 2/20 0.39
GFER P55789 2/20 0.39
HTT P42858 1/20 0.39
PLEC Q15149 1/20 0.39
CREBBP Q92793 1/20 0.39
HSD17B10 Q99714 3/20 0.39
GLA P06280 2/20 0.39
CASP7 P55210 1/20 0.39
ATM Q13315 1/20 0.39
CYP3A4 P08684 2/20 0.38
NPC1 O15118 5/20 0.38
RAB9A P51151 3/20 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
SCHEMBL28632380 0.86 MAPT (0.43) MAPTTDP1PRKCIALDH1A1GAA
SCHEMBL9279519 0.83 LMNA (0.51) MAPTALDH1A1GAAHTTGLA
SCHEMBL11569656 0.82 MAPT (0.50) MAPTTDP1PRKCIALDH1A1CASP1
SCHEMBL7049515 0.81 MAPT (0.66) MAPTTDP1ALDH1A1CASP1GAA
SCHEMBL8281122 0.81 HDAC1 (0.41) MAPTTDP1PRKCIALDH1A1CASP1
SCHEMBL27450524 0.79 ALDH1A1 (0.47) MAPTTDP1PRKCIALDH1A1CASP1
SCHEMBL571550 0.79 MAPT (0.73) MAPTTDP1PRKCIALDH1A1CASP1
SCHEMBL24403947 0.79 MAPT (0.61) MAPTTDP1ALDH1A1CASP1GAA
SCHEMBL8399254 0.79 MAPT (0.61) MAPTTDP1NPC1RAB9ALMNA
SCHEMBL16064398 0.79 HDAC1 (0.59) MAPTALDH1A1HTTNPC1RAB9A

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
US-5489672-A COUPLING-REACTING A SOLUTION OF TETRAZONIUM SALT OF BENZIDINE WITH A SLURRY OF ACETOACETANILIDE; ADDING HALOGEN TO SLURRY TOYO INK MANUFACTURING CO., LTD. (JP) 1996-02-06 US disclosed