SCHEMBL1748663

SCHEMBL1748663

COc1cc2c(-c3cc4c(C#N)ccnc4n3S(=O)(=O)c3ccc(C)cc3)cn(C)c2cc1OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.41
IGF1R P08069 1/20 0.37
PRKDC P78527 1/20 0.36
TP53 P04637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
HSD11B1 P28845 1/20 0.34
EIF2AK3 Q9NZJ5 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
MET P08581 1/20 0.33
AXL P30530 1/20 0.33
HTR6 P50406 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
IMPDH2 P12268 1/20 0.33

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
SCHEMBL2990286 0.89 PTGDR2 (0.39) PTGDR2IGF1RPRKDCKDM4EPOLB
SCHEMBL1779126 0.89 HTR6 (0.40) PTGDR2IGF1RHTR6PDE4B
SCHEMBL1749121 0.88 IGF1R (0.40) PTGDR2IGF1RTP53KDM4EPCSK9
SCHEMBL1748958 0.87 IGF1R (0.38) PTGDR2IGF1RTP53KDM4EPCSK9
SCHEMBL1749150 0.86 IGF1R (0.39) PTGDR2IGF1RPRKDCTP53KDM4E
SCHEMBL1748718 0.86 PTGDR2 (0.39) PTGDR2IGF1RTP53KDM4EPCSK9
SCHEMBL27688034 0.86 IGF1R (0.40) PTGDR2IGF1RTP53PCSK9MET
SCHEMBL5806641 0.84 IGF1R (0.37) PTGDR2IGF1RTP53PCSK9MET
SCHEMBL1749798 0.84 PTGDR2 (0.39) PTGDR2IGF1RTP53PCSK9MET
SCHEMBL1748824 0.84 IGF1R (0.39) PTGDR2IGF1RTP53PCSK9MET

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-7968566-B2 Pyrrolo(2,3-b) pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2011-06-28 US disclosed
US-20090233956-A1 NOVEL PYRROLO(2,3-b) PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2009-09-17 US disclosed
US-7528147-B2 Pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2009-05-05 US disclosed
US-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2007-04-26 US disclosed
CN-1950083-A Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA SA (FR) 2007-04-18 CN 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-20090233956-A1 NOVEL PYRROLO(2,3-b) PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS MAP3K19, MAP4K2, MAP3K1 PTGDR2 806/4885IGF1R 817/4885PRKDC 118/4885
US-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors MAP3K19, MAP4K2, MAP3K1 PTGDR2 806/4885IGF1R 817/4885PRKDC 118/4885

“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.