SCHEMBL11293754

SCHEMBL11293754

CCN(C(C)=O)C(C)Nc1cccc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSK P43235 1/20 0.43
NPSR1 Q6W5P4 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
SAE1 Q9UBE0 1/20 0.40
UBA2 Q9UBT2 1/20 0.40

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
SCHEMBL11310422 0.76 MAPT (0.47) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL9435083 0.73 HSD17B10 (0.53) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL31174454 0.72 TDP1 (0.56) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL632551 0.72 TDP1 (0.56) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL29588182 0.70 NPSR1 (0.53) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL4431825 0.70 NPSR1 (0.53) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL4431827 0.70 NPSR1 (0.53) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL10994611 0.70 HSD17B10 (0.53) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL7025738 0.70 CYP3A4 (0.57) HSD17B10GAANPSR1ALDH1A1MAPT
SCHEMBL6249680 0.69 SYK (0.56) HSD17B10GAAALDH1A1MAPTMEN1

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-0007787-B1 METHOD AND REAGENT FOR THE QUANTITATIVE DETERMINATION OF HYDROGEN PEROXIDE KYOWA HAKKO KOGYO CO., LTD (JP) 1982-11-03 EP disclosed