SCHEMBL5046787

SCHEMBL5046787

CO/C=C(/C(=O)O)c1ccccc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 3/20 0.52
NPC1 O15118 1/20 0.50
HTT P42858 1/20 0.50
GAA P10253 1/20 0.49
LIPE Q05469 1/20 0.49
PTGER1 P34995 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 1/20 0.47
RXRA P19793 1/20 0.47
PARP1 P09874 1/20 0.47
BRD4 O60885 1/20 0.47

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
SCHEMBL5046789 1.00 SGMS2 (0.52) SGMS2NPC1HTTGAALIPE
SCHEMBL10442994 1.00 SGMS2 (0.52) SGMS2NPC1HTTGAALIPE
SCHEMBL1097807 0.89 SGMS2 (0.57) SGMS2NPC1HTTGAAMEN1
SCHEMBL7164705 0.89 SGMS2 (0.57) SGMS2NPC1HTTGAAMEN1
SCHEMBL712291 0.89 SGMS2 (0.57) SGMS2NPC1HTTGAAMEN1
SCHEMBL8827709 0.87 SGMS2 (0.56) SGMS2NPC1HTTGAALIPE
SCHEMBL9730334 0.85 SGMS2 (0.47) SGMS2NPC1HTTGAALIPE
SCHEMBL9647587 0.85 SGMS2 (0.47) SGMS2NPC1HTTGAALIPE
SCHEMBL10864744 0.84 SGMS2 (0.56) SGMS2NPC1HTTGAALIPE
SCHEMBL7768796 0.83 PDE4A (0.47) MEN1KMT2ALMNAMAPT

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-2308825-B1 Process for the preparation of an intermediate for azoxystrobin SYNGENTA LTD (GB) 2014-05-21 EP disclosed
EP-1891020-B1 PROCESSES FOR THE PREPARATION OF AZOXYSTROBIN USING DABCO AS A CATALYST AND NOVEL INTERMEDIATES USED IN THE PROCESSES SYNGENTA LTD (GB) 2013-06-05 EP disclosed
US-20080214587-A1 Processes For the Preparation of Azoxystrobin Using Dabco as a Catalyst and Novel Intermediates Used in the Processes SYNGENTA CROP PROTECTION, INC. (US) 2008-09-04 US disclosed
EP-1891020-A2 PROCESSES FOR THE PREPARATION OF AZOXYSTROBIN USING DABCO AS A CATALYST AND NOVEL INTERMEDIATES USED IN THE PROCESSES Syngenta Limited (GB) 2008-02-27 EP disclosed
WO-2006114572-A2 PROCESSES FOR THE PREPARATION OF AZOXYSTROBIN USING DABCO AS A CATALYST AND NOVEL INTERMEDIATES USED IN THE PROCESSES SYNGENTA LIMITED (GB) 2006-11-02 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-20080214587-A1 Processes For the Preparation of Azoxystrobin Using Dabco as a Catalyst and Novel Intermediates Used in the Processes DDT, AOC3, DAO SGMS2 4000/4885NPC1 4635/4885HTT 4603/4885

“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.