SCHEMBL5220175

SCHEMBL5220175

CCOC(=O)c1cc(N2CCCC2=O)c2c(c1)c(CC)cn2C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.48
BACE1 P56817 1/20 0.48
BACE2 Q9Y5Z0 1/20 0.48
MAPT P10636 3/20 0.42
HSD17B10 Q99714 3/20 0.40
PKM P14618 1/20 0.40
CASP6 P55212 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.38
ALOX5 P09917 1/20 0.38
CYP2C9 P11712 2/20 0.37
CYP3A4 P08684 1/20 0.37
SRD5A1 P18405 1/20 0.37
SRD5A2 P31213 1/20 0.37
MAPK1 P28482 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL5223584 0.89 CTSD (0.51) CTSDBACE1BACE2HSD17B10PKM
SCHEMBL5217794 0.86 MAPT (0.40) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5220196 0.79 ALDH1A1 (0.35) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5220188 0.79 KDM4E (0.39) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5222278 0.78 CTSD (0.48) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5221500 0.75 CTSD (0.46) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5221844 0.75 HSD17B10 (0.43) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5388944 0.74 BRD4 (0.44) CTSDBACE1BACE2HSD17B10ALDH1A1
SCHEMBL5222117 0.72 CTSD (0.42) CTSDBACE1BACE2MAPTHSD17B10
SCHEMBL5226060 0.72 ALDH1A1 (0.40) CTSDBACE1BACE2HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253198-B2 Hydroxyethylamine derivatives for the treatment of Alzheimer's disease GLAXO GROUP LIMITED (GB) 2007-08-07 US disclosed
EP-1567488-B1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LTD (GB) 2007-02-21 EP disclosed
US-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease GLAXO GROUP LIMITED (GB) 2006-02-02 US disclosed
EP-1567488-A1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LIMITED (GB) 2005-08-31 EP disclosed
WO-2004050619-A1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LIMITED (GB) 2004-06-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease BACE2, PSEN2, BACE1 CTSD 384/4885BACE1 3/4885BACE2 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.