SCHEMBL4090737

SCHEMBL4090737

CC(C)(C)OC(=O)Oc1cc2ccccc2o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.44
MAPT P10636 3/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAOB P27338 4/20 0.43
MAOA P21397 3/20 0.43
KDM4E B2RXH2 6/20 0.42
ALDH1A1 P00352 6/20 0.42
CYP1A2 P05177 3/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
NT5E P21589 1/20 0.42
ELANE P08246 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 4/20 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
SCHEMBL6607462 0.83 ALDH1A1 (0.53) FLT3MAPTCASP3SENP7TDP1
SCHEMBL8789115 0.82 FLT3 (0.50) FLT3MAPTCASP3SENP7TDP1
SCHEMBL27512860 0.80 FLT3 (0.47) FLT3MAPTCASP3SENP7TDP1
SCHEMBL3807363 0.79 KDM4E (0.51) FLT3MAPTCASP3SENP7TDP1
SCHEMBL4200612 0.77 FLT3 (0.52) FLT3MAPTCASP3SENP7TDP1
SCHEMBL10831738 0.76 FLT3 (0.55) FLT3MAPTCASP3SENP7TDP1
SCHEMBL289080 0.76 FLT3 (0.50) FLT3MAPTCASP3SENP7TDP1
SCHEMBL116771 0.75 ALDH1A1 (0.48) FLT3MAPTCASP3SENP7TDP1
SCHEMBL27829877 0.75 NCEH1 (0.49) FLT3MAPTCASP3SENP7TDP1
SCHEMBL29926214 0.75 MAPT (0.60) FLT3MAPTCASP3SENP7TDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081543-A2 BLEACHING AGENT COMPRISING PIPERIDONE/S AND IMIDAZOLE/S Henkel AG & Co. KGaA (DE) 2009-07-29 EP disclosed
WO-2008095558-A2 BLEACHING AGENT COMPRISING PIPERIDONE/S AND IMIDAZOLE/S HENKEL AG & CO. KGAA (DE) 2008-08-14 WO disclosed