SCHEMBL2547494

SCHEMBL2547494

COc1ccc(CN(CCCc2ccccc2)c2ccc3nc[nH]c3c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 15/20 0.71
MMP12 P39900 1/20 0.48
QPCTL Q9NXS2 4/20 0.47
DRD2 P14416 1/20 0.42

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
SCHEMBL15267609 0.92 QPCT (0.59) QPCTMMP12QPCTL
SCHEMBL2546387 0.91 QPCT (0.83) QPCTMMP12QPCTL
SCHEMBL2546550 0.86 QPCT (0.60) QPCTMMP12QPCTL
SCHEMBL2541701 0.83 QPCT (1.00) QPCTMMP12QPCTL
SCHEMBL2546223 0.77 QPCT (0.69) QPCTMMP12QPCTL
SCHEMBL15267629 0.74 QPCT (0.84) QPCTMMP12
SCHEMBL25425979 0.74 QPCT (0.80) QPCTMMP12QPCTL
SCHEMBL30245579 0.74 QPCT (0.80) QPCTMMP12QPCTL
SCHEMBL2540372 0.73 QPCT (0.64) QPCTMMP12QPCTL
SCHEMBL12634028 0.73 QPCT (0.47) QPCTMMP12QPCTL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560953-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-01-06 EP claimed
US-8541596-B2 Inhibitors PROBIODRUG AG (DE) 2013-09-24 US claimed
EP-2560953-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-01-06 EP disclosed
EP-2560953-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-01-06 EP disclosed
US-8541596-B2 Inhibitors PROBIODRUG AG (DE) 2013-09-24 US disclosed
US-8541596-B2 Inhibitors PROBIODRUG AG (DE) 2013-09-24 US disclosed
EP-2560953-A2 NOVEL INHIBITORS Probiodrug AG (DE) 2013-02-27 EP disclosed
US-20110262388-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-10-27 US disclosed
US-20110262388-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-10-27 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-20110262388-A1 NOVEL INHIBITORS GLUL, QPCT, GLS QPCT 2/4885MMP12 3622/4885QPCTL 8/4885

“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.