SCHEMBL56466

SCHEMBL56466

COP(=O)(CCC(C(=O)OCc1ccccc1)N(C=O)OCc1ccccc1)Oc1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
BTN3A1 O00481 1/20 0.36
ELANE P08246 2/20 0.35
PRTN3 P24158 2/20 0.35
PPARG P37231 4/20 0.34
PPARA Q07869 4/20 0.34
ADAMTS5 Q9UNA0 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL57115 0.93 ATM (0.39) BTN3A1ELANEPRTN3MEN1KMT2A
SCHEMBL56408 0.92 BTN3A1 (0.37) BTN3A1ELANEPRTN3MEN1MAPT
SCHEMBL57135 0.90 MAPT (0.41) BTN3A1ELANEPRTN3MAPTKMT2A
SCHEMBL56935 0.89 ALDH1A1 (0.41) BTN3A1ELANEPRTN3PPARGPPARA
SCHEMBL56920 0.88 MMP2 (0.37) BTN3A1ELANEPRTN3PPARGPPARA
SCHEMBL56614 0.88 MAOB (0.37) BTN3A1ELANEPRTN3MEN1MAPT
SCHEMBL56739 0.88 GAA (0.38) MEN1MAPTKMT2A
SCHEMBL57805 0.86 KYNU (0.35) ELANEPRTN3
SCHEMBL56758 0.85 ALDH1A1 (0.39) BTN3A1MEN1MAPTKMT2A
SCHEMBL57868 0.84 L3MBTL1 (0.37) BTN3A1ELANEPRTN3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008137446-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF RESPIRATORY DISEASE TRUSTEES OF BOSTON UNIVERSITY (US) 2008-11-13 WO claimed
US-8129557-B2 Phosphonic acid diester derivative and method for producing thereof Nagai, Kazuhiro (JP) 2012-03-06 US disclosed
US-20090163725-A1 PHOSPHONIC ACID DIESTER DERIVATIVE AND METHOD FOR PRODUCING THEREOF HIRATAKE, GOU (JP) 2009-06-25 US disclosed
WO-2008137446-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF RESPIRATORY DISEASE TRUSTEES OF BOSTON UNIVERSITY (US) 2008-11-13 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-20090163725-A1 PHOSPHONIC ACID DIESTER DERIVATIVE AND METHOD FOR PRODUCING THEREOF PPA1, G6PD, PHOSPHO1 TP53 1700/4885BTN3A1 4679/4885ELANE 2769/4885

“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.