SCHEMBL1748952

SCHEMBL1748952

COc1cc2c(-c3cc4cccnc4[nH]3)cn(C)c2cc1C

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 4/20 0.85
SYK P43405 1/20 0.51
GSK3B P49841 5/20 0.49
CDK7 P50613 4/20 0.49
LRRK2 Q5S007 4/20 0.49
AURKB Q96GD4 4/20 0.49
GSK3A P49840 4/20 0.49
LCK P06239 3/20 0.49
JAK2 O60674 3/20 0.49
BTK Q06187 1/20 0.49
RIPK1 Q13546 8/20 0.47
CCNB2 O95067 2/20 0.46
CDK1 P06493 2/20 0.46
CCNB1 P14635 2/20 0.46
CCNB3 Q8WWL7 2/20 0.46
RET P07949 5/20 0.43
CDK5 Q00535 4/20 0.43
AURKA O14965 3/20 0.43
ABL1 P00519 3/20 0.43
FLT3 P36888 3/20 0.43

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
SCHEMBL1780899 0.92 IGF1R (1.00) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1777615 0.88 IGF1R (0.84) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1778539 0.87 IGF1R (0.90) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1779018 0.86 IGF1R (0.84) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1776436 0.85 IGF1R (0.86) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1749198 0.85 IGF1R (0.84) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1748786 0.84 IGF1R (0.83) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1749295 0.83 IGF1R (0.81) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1749103 0.82 IGF1R (0.80) IGF1RSYKGSK3BCDK7LRRK2
SCHEMBL1777168 0.82 IGF1R (0.74) IGF1RSYKGSK3BCDK7LRRK2

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 4 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

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 379/4885GSK3B 536/4885
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 379/4885GSK3B 536/4885

“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.