SCHEMBL4495087

SCHEMBL4495087

CS(=O)(=O)CCNc1nc(Oc2ccc(F)cc2F)nc2[nH]nc(-c3cc(F)ccc3F)c12

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.64
MAPK11 Q15759 1/20 0.47
LPAR2 Q9HBW0 1/20 0.35
MAPK8 P45983 1/20 0.35
PTGS2 P35354 1/20 0.35
BRD4 O60885 3/20 0.35

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
SCHEMBL4015105 0.95 MAPK14 (0.57) MAPK14MAPK11LPAR2MAPK8
SCHEMBL4021362 0.90 MAPK14 (0.51) MAPK14MAPK11LPAR2MAPK8PTGS2
SCHEMBL4840801 0.89 MAPK14 (0.59) MAPK14MAPK11LPAR2MAPK8PTGS2
SCHEMBL4012451 0.89 MAPK14 (0.58) MAPK14MAPK11LPAR2MAPK8
SCHEMBL4844809 0.84 MAPK14 (0.53) MAPK14MAPK11LPAR2MAPK8PTGS2
SCHEMBL4013208 0.84 MAPK14 (0.52) MAPK14MAPK11LPAR2MAPK8PTGS2
SCHEMBL4020032 0.84 MAPK14 (0.43) MAPK14MAPK11LPAR2BRD4
SCHEMBL4016081 0.83 MAPK14 (0.42) MAPK14MAPK11LPAR2
SCHEMBL4012931 0.82 MAPK14 (0.43) MAPK14MAPK11MAPK8BRD4
SCHEMBL4015197 0.82 MAPK14 (0.46) MAPK14MAPK11LPAR2

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
US-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
US-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
US-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
EP-1919914-A2 P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME F.HOFFMANN-LA ROCHE AG (CH) 2008-05-14 EP disclosed
US-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 US disclosed
US-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 US disclosed
US-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 US disclosed
WO-2007023115-A2 P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME F. HOFFMANN-LA ROCHE AG (CH) 2007-03-01 WO 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-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same MAPK1, MAPK9, MAPK3 MAPK14 22/4885MAPK11 24/4885LPAR2 2406/4885

“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.