SCHEMBL3227739

SCHEMBL3227739

FC(F)(F)c1ccccc1-c1cccn2cncc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 1/20 0.48
QPCTL Q9NXS2 1/20 0.48
CYP3A4 P08684 9/20 0.46
CYP2D6 P10635 9/20 0.46
CYP2C19 P33261 9/20 0.46
CYP1A2 P05177 8/20 0.46
HSD11B1 P28845 3/20 0.41
IDO1 P14902 2/20 0.41
ALOX15 P16050 5/20 0.41
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 4/20 0.41
MAPK1 P28482 3/20 0.41
LMNA P02545 3/20 0.40
CLK4 Q9HAZ1 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
TDO2 P48775 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL938764 0.85 IDO1 (0.43) QPCTQPCTLCYP3A4CYP2D6CYP2C19
SCHEMBL3227840 0.79 QPCT (0.51) QPCTQPCTLCYP1A2IDO1ALDH1A1
SCHEMBL3223291 0.78 QPCT (0.48) QPCTQPCTLHSD11B1IDO1ALDH1A1
SCHEMBL3224883 0.76 QPCT (0.51) QPCTQPCTLCYP3A4CYP2D6CYP2C19
SCHEMBL12698831 0.76 QPCT (0.59) QPCTQPCTLIDO1CLK4TDO2
SCHEMBL3260750 0.75 QPCT (0.67) QPCTQPCTLIDO1CLK4TDO2
SCHEMBL14881895 0.75 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C19CYP1A2HSD11B1
SCHEMBL12698760 0.72 QPCT (0.68) QPCTQPCTLCYP3A4IDO1ALOX15
SCHEMBL3217600 0.72 QPCT (0.62) QPCTQPCTLCYP3A4CYP2D6CYP2C19
SCHEMBL12698776 0.72 QPCT (0.51) QPCTQPCTLIDO1TDO2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2118101-B1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2012-09-26 EP claimed
US-7803810-B2 Inhibitors PROBIODRUG AG (DE) 2010-09-28 US claimed
US-20080234313-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2008-09-25 US claimed
EP-2118101-B1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2012-09-26 EP disclosed
EP-2118101-B1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2012-09-26 EP disclosed
US-7803810-B2 Inhibitors PROBIODRUG AG (DE) 2010-09-28 US disclosed
US-7803810-B2 Inhibitors PROBIODRUG AG (DE) 2010-09-28 US disclosed
US-7803810-B2 Inhibitors PROBIODRUG AG (DE) 2010-09-28 US disclosed
EP-2118101-A1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE Probiodrug AG (DE) 2009-11-18 EP disclosed
US-20080234313-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2008-09-25 US disclosed
US-20080234313-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2008-09-25 US disclosed
US-20080234313-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2008-09-25 US disclosed
WO-2008110523-A1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-09-18 WO disclosed
WO-2008110523-A1 IMIDAZO [1,5-A] PYRIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2008-09-18 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-20080234313-A1 NOVEL INHIBITORS SF3A1, HBS1L, SF3A3 QPCT 4475/4885QPCTL 4381/4885CYP3A4 378/4885

“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.