SCHEMBL2397541

SCHEMBL2397541

Clc1ccc(CC(Cl)c2nnc(-c3ccc4[nH]cnc4c3)s2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 14/20 0.42
QPCT Q16769 7/20 0.41
CDK2 P24941 2/20 0.41
AKT1 P31749 2/20 0.41
KDM4E B2RXH2 1/20 0.35
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
NOTUM Q6P988 1/20 0.35
POLB P06746 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
SCHEMBL2397418 0.81 QPCTL (0.57) QPCTLQPCT
SCHEMBL2397364 0.78 QPCTL (0.44) QPCTLQPCTCDK2AKT1
SCHEMBL2395930 0.76 QPCT (0.52) QPCTLQPCT
SCHEMBL2399874 0.76 QPCTL (0.46) QPCTLQPCTKDM4E
SCHEMBL2395994 0.75 QPCTL (0.49) QPCTLQPCT
SCHEMBL13373351 0.71 ALDH1A1 (0.46) QPCTLQPCTKDM4EPOLB
SCHEMBL2397537 0.70 QPCTL (0.57) QPCTLQPCTCDK2AKT1
SCHEMBL2396653 0.69 QPCTL (0.58) QPCTLQPCT
SCHEMBL2397900 0.69 QPCT (0.46) QPCTLQPCTCDK2AKT1
SCHEMBL2397538 0.68 QPCTL (0.84) QPCTLQPCT

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-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
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

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 5/4885QPCT 1/4885CDK2 1210/4885

“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.