SCHEMBL2396207

SCHEMBL2396207

Clc1ccc(Cn2cnnc2-c2ccc3[nH]cnc3c2)c(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 5/20 0.66
P2RX7 Q99572 3/20 0.52
ACP1 P24666 1/20 0.48
LMNA P02545 1/20 0.41
QPCT Q16769 1/20 0.40
CDC7 O00311 1/20 0.39
DBH P09172 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SLC9A1 P19634 1/20 0.36
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
DPP4 P27487 1/20 0.34

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
SCHEMBL2397189 0.91 QPCTL (0.66) QPCTLP2RX7ACP1LMNADBH
SCHEMBL2397851 0.88 QPCTL (0.84) QPCTLP2RX7ACP1QPCT
SCHEMBL2399845 0.86 QPCTL (0.63) QPCTLP2RX7ACP1QPCTMAPK1
SCHEMBL2396002 0.84 QPCTL (0.84) QPCTLP2RX7
SCHEMBL2395188 0.83 QPCTL (0.59) QPCTLP2RX7ACP1QPCTDBH
SCHEMBL2398152 0.83 QPCTL (0.58) QPCTLP2RX7ACP1DBHHTT
SCHEMBL2396678 0.82 QPCTL (0.66) QPCTLP2RX7ACP1MAPK1SMN1; SMN2
SCHEMBL2395959 0.81 QPCTL (0.66) QPCTLP2RX7LMNAQPCTDBH
SCHEMBL2397632 0.81 QPCTL (0.62) QPCTLP2RX7QPCT
SCHEMBL2397290 0.81 QPCTL (0.68) QPCTLP2RX7ACP1QPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2542549-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-05-11 EP claimed
US-9181233-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-11-10 US claimed
EP-2542549-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-05-11 EP disclosed
EP-2542549-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-05-11 EP disclosed
US-9181233-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-11-10 US disclosed
US-9181233-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-11-10 US disclosed
US-9181233-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-11-10 US disclosed
US-20110224259-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-09-15 US disclosed
US-20110224259-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-09-15 US disclosed
US-20110224259-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-09-15 US disclosed
WO-2011107530-A2 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-09-09 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-20110224259-A1 NOVEL INHIBITORS QPCT, GLUL, GLS QPCTL 5/4885P2RX7 3232/4885ACP1 967/4885

“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.