SCHEMBL1562403

SCHEMBL1562403

CCOC(=O)C(N(Cc1ccccc1)Cc1ccccc1)C(C)(C)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MMP8 P22894 2/20 0.43
RIPK1 Q13546 2/20 0.43
AKT1 P31749 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HTT P42858 1/20 0.42
PIN1 Q13526 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL1561608 0.83 RIPK1 (0.45) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL6363989 0.78 L3MBTL1 (0.59) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL11165873 0.78 L3MBTL1 (0.59) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL3632576 0.77 L3MBTL1 (0.54) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL28046807 0.77 L3MBTL1 (0.50) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL25060413 0.76 ALDH1A1 (0.52) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL31489074 0.76 L3MBTL1 (0.52) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL23027133 0.76 ALDH1A1 (0.52) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL13064940 0.76 L3MBTL1 (0.52) L3MBTL1ALDH1A1LMNAPOLBHSD17B10
SCHEMBL29623887 0.74 RIPK1 (0.46) L3MBTL1ALDH1A1LMNAPOLBHSD17B10

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
EP-1828151-B1 MALONAMIDE DERIVATIVES AS INHIBITORS OF GAMMA-SECRETASE FOR THE TREATMENT OF ALZHEIMER'S DISEASE HOFFMANN LA ROCHE (CH) 2011-04-06 EP disclosed
EP-1828151-A2 MALONAMIDE DERIVATIVES AS INHIBITORS OF GAMMA-SECRETASE FOR THE TREATMENT OF ALZHEIMER'S DISEASE F.HOFFMANN-LA ROCHE AG (CH) 2007-09-05 EP disclosed
US-7211573-B2 Malonamide derivatives HOFFMANN-LA ROCHE INC. (US) 2007-05-01 US disclosed
WO-2006061136-A2 MALONAMIDE DERIVATIVES AS INHIBITORS OF GAMMA-SECRETASE FOR THE TREATMENT OF ALZHEIMER’S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2006-06-15 WO disclosed
US-20060122168-A1 Malonamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 US 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-20060122168-A1 Malonamide derivatives ACE, REN, ME1 L3MBTL1 2396/4885ALDH1A1 331/4885LMNA 2948/4885

“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.