SCHEMBL5451180

SCHEMBL5451180

CCCCNc1cccc2c(-c3ccnc(NC4CC4)n3)c(-c3ccc(F)cc3)nn12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.49
CSNK1D P48730 1/20 0.46
CDK4 P11802 3/20 0.45
MAPK14 Q16539 5/20 0.45
AXL P30530 3/20 0.42
GSK3B P49841 2/20 0.42
MAPK13 O15264 1/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
MERTK Q12866 2/20 0.42
TYRO3 Q06418 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK9 P45984 1/20 0.41

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
SCHEMBL5449738 0.97 KDR (0.46) KDRCSNK1DCDK4MAPK14AXL
SCHEMBL5453421 0.93 MERTK (0.45) KDRCSNK1DMAPK14AXLGSK3B
SCHEMBL5457524 0.90 GSK3B (0.46) MAPK14AXLGSK3BMERTKTYRO3
SCHEMBL5460142 0.89 GSK3B (0.45) MAPK14AXLGSK3BMERTKTYRO3
SCHEMBL5449793 0.89 KDR (0.46) KDRCSNK1DCDK4MAPK14AXL
SCHEMBL6112342 0.88 KDR (0.41) KDRCSNK1DCDK4MAPK14AXL
SCHEMBL5464066 0.86 GSK3B (0.43) MAPK14AXLGSK3BMERTK
SCHEMBL5452168 0.85 GSK3B (0.45) MAPK14AXLGSK3BMERTKTYRO3
SCHEMBL6105831 0.85 MERTK (0.43) KDRCDK4AXLMERTKTYRO3
SCHEMBL5457474 0.85 GSK3B (0.49) KDRCSNK1DMAPK14AXLGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1377573-B1 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2005-07-27 EP claimed
US-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
US-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
US-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
US-7163940-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-16 US disclosed
US-7163940-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-16 US disclosed
EP-1377573-B1 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2005-07-27 EP 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-20070287721-A1 Pyrazolopyridinyl pyridine CYP3A5, CYP2C19, CYP3A4 KDR 3259/4885CSNK1D 411/4885CDK4 293/4885

“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.