SCHEMBL5221387

SCHEMBL5221387

COC(=O)c1cc(N)cc(OCc2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
HPGD P15428 1/20 0.62
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
MAOB P27338 3/20 0.52
NR4A2 P43354 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LNPEP Q9UIQ6 3/20 0.50
SMPD1 P17405 1/20 0.50
MRGPRX4 Q96LA9 2/20 0.49
PARP10 Q53GL7 1/20 0.49
PTPN1 P18031 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NR4A1 P22736 1/20 0.48
NR4A3 Q92570 1/20 0.48

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
Hydrochloric Acid SCHEMBL5221379 0.99 LMNA (0.60) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL391547 0.90 MEN1 (0.71) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL183994 0.90 LMNA (0.70) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL417403 0.87 KMT2A (0.59) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL12579133 0.86 LMNA (0.55) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL3129603 0.86 MEN1 (0.74) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL7110511 0.86 MAOB (0.67) MEN1KMT2AMAOBNR4A2SMN1; SMN2
SCHEMBL29788280 0.86 LMNA (0.65) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL29475634 0.86 LMNA (0.69) LMNAHPGDMEN1KMT2AMAOB
SCHEMBL90412 0.86 LMNA (0.69) LMNAHPGDMEN1KMT2AMAOB

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 LMNA 1062/4885HPGD 2131/4885MEN1 586/4885

“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.