SCHEMBL1749017

SCHEMBL1749017

COc1cc2c(-c3cc4cccnc4[nH]3)cn(C)c2cc1OCC(=O)N1CCN(C)CC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.70
SYK P43405 1/20 0.51
RIPK1 Q13546 3/20 0.48
HRH4 Q9H3N8 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
GAA P10253 1/20 0.43
ADRA1A P35348 2/20 0.42
ADRA1B P35368 2/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
HTR1A P08908 2/20 0.40
HTR1D P28221 2/20 0.40
HTR1B P28222 2/20 0.40
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
JAK2 O60674 1/20 0.39
LCK P06239 1/20 0.39
GSK3A P49840 1/20 0.39

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
SCHEMBL1748773 0.97 IGF1R (0.66) IGF1RSYKRIPK1HRH4HRH3
SCHEMBL1748575 0.92 IGF1R (0.68) IGF1RSYKRIPK1GAATP53
SCHEMBL1748512 0.89 IGF1R (0.62) IGF1RSYKRIPK1HRH4HRH3
SCHEMBL5795386 0.88 IGF1R (0.54) IGF1RSYKRIPK1GAAADRA1A
SCHEMBL1749103 0.87 IGF1R (0.80) IGF1RSYKRIPK1DRD2DRD3
Trifluoroacetic Acid SCHEMBL5795497 0.86 IGF1R (0.52) IGF1RSYKRIPK1HRH4HRH3
Acetamide SCHEMBL5795493 0.85 IGF1R (0.51) IGF1RSYKRIPK1HRH4HRH3
SCHEMBL1748771 0.85 IGF1R (0.75) IGF1RSYKRIPK1HRH4HRH3
SCHEMBL1749191 0.85 IGF1R (0.62) IGF1RSYKRIPK1GAATP53
SCHEMBL1780899 0.84 IGF1R (1.00) IGF1RSYKRIPK1JAK2LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
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

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 IGF1R 817/4885SYK 379/4885RIPK1 392/4885
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 IGF1R 817/4885SYK 379/4885RIPK1 392/4885

“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.