SCHEMBL5131052

SCHEMBL5131052

Cc1cn(CCCn2c(=S)[nH]c3sc(Cc4ccccc4)cc3c2=O)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 18/20 1.00
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
POLB P06746 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.41

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
SCHEMBL3637547 0.87 QPCT (1.00) QPCTALDH1A1LMNAHTTPOLB
SCHEMBL5119605 0.85 QPCT (1.00) QPCTALDH1A1KMT2A
SCHEMBL5126407 0.84 QPCT (0.73) QPCTKMT2A
SCHEMBL5127503 0.83 QPCT (1.00) QPCTALDH1A1LMNAHTTPOLB
SCHEMBL3639892 0.77 QPCT (1.00) QPCTALDH1A1KMT2A
SCHEMBL5132324 0.76 QPCT (1.00) QPCT
SCHEMBL5126792 0.73 QPCT (1.00) QPCT
SCHEMBL5126985 0.71 QPCT (0.71) QPCTALDH1A1LMNAHTTPOLB
SCHEMBL5122792 0.71 QPCT (1.00) QPCT
SCHEMBL5127461 0.69 QPCT (1.00) QPCTALDH1A1LMNAKMT2A

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-2160389-B1 THIOXOQUINAZOLINONE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2014-03-12 EP claimed
US-20080267911-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-10-30 US claimed
US-9034907-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-05-19 US disclosed
US-9034907-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-05-19 US disclosed
US-9034907-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-05-19 US disclosed
EP-2160389-B1 THIOXOQUINAZOLINONE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2014-03-12 EP disclosed
US-20080267911-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-10-30 US disclosed
US-20080267911-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-10-30 US disclosed
US-20080267911-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-10-30 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-20080267911-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE GLS, GLS2, QPCT QPCT 3/4885ALDH1A1 2499/4885LMNA 2857/4885

“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.