SCHEMBL1749485

SCHEMBL1749485

COc1cc2c(-c3cc4c(CNc5ccc(N6CCCCC6)cc5)ccnc4[nH]3)cn(C)c2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.51
L3MBTL1 Q9Y468 9/20 0.46
KDM4E B2RXH2 8/20 0.46
ALDH1A1 P00352 8/20 0.46
MAPT P10636 8/20 0.46
MAPK1 P28482 8/20 0.46
GAA P10253 8/20 0.46
TDP1 Q9NUW8 5/20 0.46
ALOX15 P16050 3/20 0.46
HTT P42858 2/20 0.46
TSHR P16473 1/20 0.46
TP53 P04637 2/20 0.44
NPC1 O15118 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
ALOX12 P18054 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
JAK2 O60674 1/20 0.39
LCK P06239 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
SCHEMBL1749106 0.93 IGF1R (0.50) IGF1RKDM4EALDH1A1MAPTMAPK1
SCHEMBL1749262 0.86 IGF1R (0.60) IGF1RMAPTMEN1KMT2AJAK2
SCHEMBL1749493 0.82 IGF1R (0.51) IGF1RMAPTJAK2LCKGSK3A
SCHEMBL27688012 0.82 IGF1R (0.58) IGF1RJAK2LCKGSK3AGSK3B
SCHEMBL2987125 0.81 TBK1 (0.45) IGF1RKDM4EALDH1A1MAPTMAPK1
SCHEMBL1749488 0.80 IGF1R (0.55) IGF1RKDM4EALDH1A1GAATDP1
SCHEMBL1750116 0.79 IGF1R (0.56) IGF1RJAK2LCKGSK3AGSK3B
SCHEMBL1749647 0.79 IGF1R (0.57) IGF1RMAPTGAASMN1; SMN2JAK2
SCHEMBL1748739 0.79 IGF1R (0.57) IGF1RKDM4EGAATDP1HTT
SCHEMBL1749105 0.79 IGF1R (0.51) IGF1RKDM4EMEN1KMT2AJAK2

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-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
EP-1732546-A2 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) 2006-12-20 EP disclosed
WO-2005095399-A2 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) 2005-10-13 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 (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 817/4885L3MBTL1 4601/4885KDM4E 981/4885
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 817/4885L3MBTL1 4601/4885KDM4E 981/4885

“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.