SCHEMBL5453367

SCHEMBL5453367

Clc1ccc(-c2nn3c(NC4CCCC4)cccc3c2-c2ccnc(NC3CCCC3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.49
MAPK10 P53779 4/20 0.49
MAPK8 P45983 3/20 0.49
MAPK9 P45984 3/20 0.49
EIF2AK2 P19525 1/20 0.48
GSK3B P49841 5/20 0.47
CDK4 P11802 2/20 0.44
ADORA1 P30542 1/20 0.42
DGAT1 O75907 1/20 0.42
KDR P35968 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL6106438 0.91 ADORA1 (0.48) IKBKBMAPK10MAPK8MAPK9EIF2AK2
SCHEMBL6105435 0.91 MAPK10 (0.52) MAPK10MAPK8MAPK9GSK3BCDK4
SCHEMBL6106109 0.91 ADORA1 (0.48) IKBKBMAPK10MAPK8MAPK9EIF2AK2
SCHEMBL6106728 0.91 ADORA1 (0.48) IKBKBMAPK10MAPK8MAPK9EIF2AK2
SCHEMBL5456838 0.90 CSNK1D (0.51) MAPK10MAPK8MAPK9GSK3BCDK4
SCHEMBL6105772 0.90 CDK4 (0.44) MAPK10MAPK8MAPK9EIF2AK2GSK3B
SCHEMBL5211093 0.90 CDK4 (0.46) MAPK10MAPK8MAPK9EIF2AK2GSK3B
SCHEMBL6108194 0.90 CDK4 (0.46) MAPK10MAPK8MAPK9EIF2AK2GSK3B
SCHEMBL5462491 0.90 CSNK1D (0.51) MAPK10MAPK8MAPK9GSK3BCDK4
SCHEMBL6105242 0.90 CDK4 (0.46) MAPK10MAPK8MAPK9EIF2AK2GSK3B

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 5 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
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 IKBKB 3058/4885MAPK10 2440/4885MAPK8 1473/4885

“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.