SCHEMBL5875605

SCHEMBL5875605

CCCCNc1cc(-c2c(-c3ccc(F)cc3)nn3c(OC)cccc23)ccn1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.56
MAPK10 P53779 1/20 0.39
MAPK13 O15264 2/20 0.39
MAPK12 P53778 2/20 0.39
MAPK11 Q15759 2/20 0.39
ADORA2A P29274 2/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
GRIA1 P42261 1/20 0.37

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
SCHEMBL5460102 0.87 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11HRH4
SCHEMBL5875497 0.81 MAPK14 (0.61) MAPK14ADORA2AADORA2BADORA1GRIA1
SCHEMBL5378779 0.81 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL5463256 0.81 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL5455979 0.79 MAPK14 (0.44) MAPK14ADORA2AADORA2BADORA1GRIA1
SCHEMBL5382408 0.79 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL5387834 0.78 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11ADORA2A
SCHEMBL5875504 0.77 MAPK14 (0.77) MAPK14ADORA2AADORA2BADORA1
SCHEMBL5379033 0.75 MAPK14 (0.58) MAPK14MAPK10MAPK13MAPK12MAPK11
SCHEMBL5448895 0.75 MAPK14 (0.61) MAPK14ADORA2AADORA2BADORA1

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-7109209-B2 Pyrazolopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-09-19 US claimed
US-7034030-B2 Pyralopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-04-25 US disclosed
US-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds ALBERTI MICHAEL J 2006-03-16 US disclosed
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-05-19 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-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds CYP3A5, CYP3A4, CYP3A7 MAPK14 2256/4885MAPK10 2405/4885MAPK13 1593/4885
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds QDPR, DPYD, ENTPD5 MAPK14 1551/4885MAPK10 2996/4885MAPK13 2280/4885

“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.