SCHEMBL3820541

SCHEMBL3820541

CC(C)(C)OC(=O)n1nc(O)c2cnc(Oc3ccc(F)cc3F)nc21

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.44
MAPK11 Q15759 1/20 0.38

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
SCHEMBL3819640 0.87 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL3822000 0.86 MAPK14 (0.45) MAPK14MAPK11
SCHEMBL13763208 0.76 MAPK14 (0.46) MAPK14MAPK11
SCHEMBL4015729 0.72 HSPB1 (0.38) MAPK14
SCHEMBL3818948 0.72 MAPK14 (0.48) MAPK14MAPK11
SCHEMBL3876871 0.69 MAPK14 (0.81) MAPK14MAPK11
SCHEMBL3867906 0.68 MAPK14 (0.46) MAPK14MAPK11
SCHEMBL13769506 0.68 DGAT2 (0.41) MAPK14
SCHEMBL4017442 0.66 MAPK14 (0.44) MAPK14MAPK11
SCHEMBL15999455 0.66 ELANE (0.34)

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-2091952-A1 PYRAZOLO Ý3, 4 -D¨PYRIMIDINE P38 MAP KINASE INHIBITORS F. Hoffmann-Roche AG (CH) 2009-08-26 EP disclosed
US-7563800-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 map kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-07-21 US disclosed
US-7563800-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 map kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-07-21 US disclosed
WO-2008074676-A1 PYRAZOLO [3, 4 -D] PYRIMIDINE P38 MAP KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-06-26 WO disclosed
WO-2008074676-A1 PYRAZOLO [3, 4 -D] PYRIMIDINE P38 MAP KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-06-26 WO disclosed
US-20080146590-A1 P38 map kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2008-06-19 US disclosed
US-20080146590-A1 P38 map kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2008-06-19 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 (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-20080146590-A1 P38 map kinase inhibitors and methods for using the same MAPK1, MAP3K1, MAP3K7 MAPK14 33/4885MAPK11 39/4885

“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.