SCHEMBL3846879

SCHEMBL3846879

Cn1ncc2c(-c3ccc(NC(=O)Nc4ccc(CN5CCNCC5)c(C(F)(F)F)c4)cc3)cncc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.53
KDR P35968 3/20 0.53
SRC P12931 4/20 0.51
ABL1 P00519 7/20 0.51
MKNK2 Q9HBH9 5/20 0.51
MKNK1 Q9BUB5 4/20 0.51
CYP3A4 P08684 2/20 0.51
BCR P11274 2/20 0.51
FGFR4 P22455 3/20 0.50
CSF1R P07333 3/20 0.47
KIT P10721 2/20 0.47
ABL2 P42684 2/20 0.46
MAPK14 Q16539 1/20 0.45
DYRK3 O43781 1/20 0.45
JAK2 O60674 1/20 0.45
ROCK2 O75116 1/20 0.45
MAP4K4 O95819 1/20 0.45
EGFR P00533 1/20 0.45
NTRK1 P04629 1/20 0.45
INSR P06213 1/20 0.45

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
SCHEMBL3852698 0.92 SRC (0.61) RETKDRSRCABL1FGFR4
SCHEMBL3851797 0.92 KDR (0.55) RETKDRSRCABL1MKNK2
SCHEMBL3847106 0.90 KDR (0.53) RETKDRSRCABL1MKNK2
SCHEMBL4232639 0.90 KDR (0.53) RETKDRSRCABL1MKNK2
SCHEMBL4226187 0.90 KDR (0.53) RETKDRSRCABL1MKNK2
SCHEMBL3842867 0.89 SRC (0.58) RETKDRSRCABL1FGFR4
SCHEMBL4220841 0.88 RET (0.53) RETKDRSRCABL1MKNK2
SCHEMBL3850946 0.88 RET (0.53) RETKDRSRCABL1MKNK2
SCHEMBL13872985 0.87 KDR (0.51) RETKDRSRCABL1MKNK2
SCHEMBL3848749 0.87 RET (0.51) RETKDRSRCABL1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125808-A2 3-H-PYRAZOLOPYRIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME Bayer Schering Pharma Aktiengesellschaft (DE) 2009-12-02 EP claimed
EP-2042500-A1 N-[4-(1-H-pyrazolo[3,4-c]pyridin-4-yl)phenyl]-N'-[(hetero)aryl]-urea compounds, pharmaceutical compositions comprising them, their preparation and their use as Tie2-kinase inhibitors Bayer Schering Pharma Aktiengesellschaft (DE) 2009-04-01 EP claimed
US-20090062273-A1 3-H-pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same. BAYER SCHERING PHARMA AG (DE) 2009-03-05 US claimed
WO-2008071456-A2 3-H-PYRAZOLOPYRIDINES AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 WO claimed
EP-2042500-A1 N-[4-(1-H-pyrazolo[3,4-c]pyridin-4-yl)phenyl]-N'-[(hetero)aryl]-urea compounds, pharmaceutical compositions comprising them, their preparation and their use as Tie2-kinase inhibitors Bayer Schering Pharma Aktiengesellschaft (DE) 2009-04-01 EP disclosed
US-20090062273-A1 3-H-pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same. BAYER SCHERING PHARMA AG (DE) 2009-03-05 US disclosed
US-20090062273-A1 3-H-pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same. BAYER SCHERING PHARMA AG (DE) 2009-03-05 US disclosed
US-20090062273-A1 3-H-pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same. BAYER SCHERING PHARMA AG (DE) 2009-03-05 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 (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-20090062273-A1 3-H-pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same. KDR, FLT4, TIE1 RET 169/4885KDR 1/4885SRC 1366/4885

“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.