SCHEMBL12274394

SCHEMBL12274394

CN1CCN(c2ccc(C3C(=O)CC(=O)N3c3ccc4[nH]cnc4c3)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 17/20 0.68
▸ QPCTL Q9NXS2 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37

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
SCHEMBL12273794 0.91 QPCT (0.70) QPCTPIK3CDPIK3CAPIK3CB
SCHEMBL12274129 0.89 QPCT (0.67) QPCTQPCTLPIK3CDPIK3CAPIK3CB
SCHEMBL12273932 0.89 QPCT (0.86) QPCTQPCTLPIK3CDPIK3CAPIK3CB
SCHEMBL12274128 0.88 QPCT (0.66) QPCTQPCTLPIK3CDPIK3CAPIK3CB
SCHEMBL12274265 0.88 QPCT (0.68) QPCTQPCTLPIK3CDPIK3CAPIK3CB
SCHEMBL12274427 0.88 QPCT (0.68) QPCTQPCTLPIK3CDPIK3CAPIK3CB
SCHEMBL12273563 0.86 QPCT (0.66) QPCT
SCHEMBL12274345 0.84 QPCT (0.62) QPCTQPCTL
SCHEMBL12456230 0.82 QPCT (0.52) QPCTQPCTLKDM4E
SCHEMBL12274403 0.82 QPCT (0.61) QPCT

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-2686313-B1 BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-02-03 — — EP disclosed
EP-2686313-A1 BENZ IMIDAZOLE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE Probiodrug AG (DE) 2014-01-22 — — EP disclosed
US-8530670-B2 Inhibitors PROBIODRUG AG (DE) 2013-09-10 — — US disclosed
US-20120237475-A1 Novel Inhibitors PROBIODRUG AG (DE) 2012-09-20 — — US disclosed
WO-2012123563-A1 BENZ IMIDAZOLE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2012-09-20 — — 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-20120237475-A1 Novel Inhibitors GLS, NQO2, GLS2 QPCT 5/4885QPCTL 13/4885MEN1 2045/4885

“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.

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