SCHEMBL402786

SCHEMBL402786

CC(=O)NC1COC(COC(C)=O)C[C@H]1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 3/20 0.42
KLK5 Q9Y337 3/20 0.42
ALDH1A1 P00352 1/20 0.42
BCHE P06276 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 1/20 0.38
MGLL Q99685 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL402975 0.88 KLK7 (0.44) KLK7KLK5BCHEL3MBTL1SMN1; SMN2
SCHEMBL402461 0.86 KLK7 (0.41) KLK7KLK5BCHEL3MBTL1SMN1; SMN2
SCHEMBL402695 0.84 ALDH1A1 (0.46) KLK7KLK5ALDH1A1BCHEL3MBTL1
SCHEMBL19976411 0.83 BCHE (0.46) KLK7KLK5ALDH1A1BCHELMNA
SCHEMBL402948 0.82 ALDH1A1 (0.41) ALDH1A1BCHEKMT2AMGLL
SCHEMBL14363003 0.79 LMNA (0.45) KLK7KLK5ALDH1A1BCHEL3MBTL1
SCHEMBL24777143 0.79 CA12 (0.38) ALDH1A1BCHELMNAKMT2ANPSR1
SCHEMBL24943597 0.79 CA12 (0.38) ALDH1A1BCHELMNAKMT2ANPSR1
SCHEMBL14362885 0.78 ALDH1A1 (0.39) KLK7KLK5ALDH1A1BCHEMGLL
SCHEMBL404432 0.77 LMNA (0.44) KLK7KLK5ALDH1A1BCHEL3MBTL1

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
US-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF SANOFI-AVENTIS (FR) 2012-03-15 US disclosed
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof SANOFI-AVENTIS (FR) 2007-11-22 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 (2 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-20120065153-A1 AZASUGAR DERIVATIVES, HEPARANASE INHIBITORS, METHOD FOR PREPARING SAME, COMPOSITIONS CONTAINING SAME, USE THEREOF HPSE, HAAO, HEXD KLK7 1399/4885KLK5 1277/4885ALDH1A1 371/4885
US-20070270354-A1 Azasugar derivatives, heparanase inhibitors, method for preparing same, compositions containing same, use thereof HPSE, HAAO, HEXD KLK7 1402/4885KLK5 1250/4885ALDH1A1 364/4885

“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.