SCHEMBL12733267

SCHEMBL12733267

CCCN(C)c1ccc(C2CN(Cc3ccc(OC)cc3)C(=O)N2c2ccc3nc[nH]c3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 18/20 0.49
▸ QPCTL Q9NXS2 3/20 0.49

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
SCHEMBL12813772 0.94 QPCT (0.47) QPCTQPCTL
SCHEMBL12733251 0.88 QPCT (0.47) QPCTQPCTL
SCHEMBL12733047 0.83 QPCT (0.42) QPCTQPCTL
SCHEMBL12733261 0.83 OPRM1 (0.36) —
SCHEMBL12812830 0.79 QPCT (0.42) QPCTQPCTL
SCHEMBL12733263 0.77 QPCT (0.70) QPCTQPCTL
SCHEMBL16864400 0.77 HDAC1 (0.36) —
SCHEMBL1444538 0.74 QPCT (0.56) QPCTQPCTL
SCHEMBL18867337 0.74 QPCT (0.45) QPCTQPCTL
SCHEMBL12733048 0.72 HDAC1 (0.38) —

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
US-9650362-B2 Inhibitors PROBIODRUG AG (DE) 2017-05-16 — — US disclosed
US-9173885-B2 Inhibitors PROBIODRUG AG (DE) 2015-11-03 — — US disclosed
US-20140065095-A1 NOVEL INHIBITORS VIVORYON THERAPEUTICS N.V. (DE) 2014-03-06 — — US disclosed
US-8486940-B2 Inhibitors PROBIODRUG AG (DE) 2013-07-16 — — US disclosed
US-20110092501-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-04-21 — — 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 (2 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-20110092501-A1 NOVEL INHIBITORS GLUL, QPCT, GLS QPCT 2/4885QPCTL 6/4885
US-20140065095-A1 NOVEL INHIBITORS GLUL, QPCT, GLS QPCT 2/4885QPCTL 6/4885

“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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