SCHEMBL8145244

SCHEMBL8145244

COc1ccc(C(C)NC(=S)Nc2ccc3[nH]cnc3c2)cc1

nearest known ligand 0.84

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 15/20 0.84
KMT2A Q03164 3/20 0.49
POLB P06746 1/20 0.49
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
STAT1 P42224 1/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL3634687 1.00 QPCT (0.84) QPCTKMT2APOLBKDM4EALDH1A1
SCHEMBL3632304 1.00 QPCT (0.84) QPCTKMT2APOLBKDM4EALDH1A1
SCHEMBL3633558 0.86 QPCT (0.83) QPCTKMT2APOLBNPC1RAB9A
SCHEMBL3629554 0.86 QPCT (0.81) QPCTKMT2AKDM4EALDH1A1MAPT
SCHEMBL3629704 0.80 QPCT (0.81) QPCTKMT2AKDM4EALDH1A1MAPT
SCHEMBL3633668 0.79 QPCT (0.84) QPCTKMT2AALDH1A1MAOAMAOB
SCHEMBL3633490 0.78 QPCT (0.82) QPCTKMT2AMAPT
SCHEMBL3632425 0.77 QPCT (0.84) QPCTPOLBKDM4EALDH1A1MAPT
SCHEMBL14012414 0.77 QPCT (1.00) QPCTKMT2AKDM4EALDH1A1MAPT
SCHEMBL3633397 0.76 QPCT (0.81) QPCTKMT2AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9656991-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2017-05-23 US disclosed
US-9656991-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2017-05-23 US disclosed
EP-2865670-B1 Thiourea derivatives as glutaminyl cyclase inhibitors PROBIODRUG AG (DE) 2017-01-11 EP disclosed
EP-2865670-A1 Thiourea derivatives as glutaminyl cyclase inhibitors Probiodrug AG (DE) 2015-04-29 EP disclosed
US-20080286231-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-11-20 US disclosed
US-20080286231-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-11-20 US disclosed
WO-2008128985-A1 THIOUREA DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2008-10-30 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-20080286231-A1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE GLS, GLS2, QPCT QPCT 3/4885KMT2A 2652/4885POLB 1626/4885

“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.