SCHEMBL3227909

SCHEMBL3227909

COc1c(C)cc(-c2cccn3cncc23)cc1C

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 1/20 0.64
QPCTL Q9NXS2 1/20 0.64
CYP17A1 P05093 2/20 0.40
SRC P12931 3/20 0.36
TBXAS1 P24557 1/20 0.36
LCK P06239 3/20 0.35
IDO1 P14902 3/20 0.35
TDO2 P48775 1/20 0.34
ALDH1A3 P47895 2/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
JAK2 O60674 1/20 0.32
BRD4 O60885 1/20 0.32

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
SCHEMBL3220223 0.84 QPCT (0.65) QPCTQPCTLCYP17A1SRCLCK
SCHEMBL3225502 0.78 QPCT (1.00) QPCTQPCTLCYP17A1SRCHDAC2
SCHEMBL3206162 0.78 QPCT (0.68) QPCTQPCTLCYP17A1SRC
SCHEMBL3218135 0.78 QPCT (0.72) QPCTQPCTLSRCTDO2ALDH1A3
SCHEMBL3260750 0.74 QPCT (0.67) QPCTQPCTLCYP17A1SRCTBXAS1
SCHEMBL3217600 0.74 QPCT (0.62) QPCTQPCTLCYP17A1LCKIDO1
SCHEMBL31280538 0.72 QPCT (0.45) QPCTQPCTLCYP17A1SRCTBXAS1
SCHEMBL4550275 0.71 SRC (0.51) QPCTQPCTLCYP17A1SRCTBXAS1
SCHEMBL12698760 0.71 QPCT (0.68) QPCTQPCTLCYP17A1TBXAS1IDO1
SCHEMBL12698953 0.71 QPCT (0.55) QPCTQPCTLCYP17A1SRCTBXAS1

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 13 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
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 4381/4885CYP17A1 382/4885

“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.