SCHEMBL5100281

SCHEMBL5100281

OCCOc1ccc(-c2n[nH]c3nc(Oc4ccc(F)cc4F)ncc23)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.50
MAPK11 Q15759 1/20 0.46
LPAR2 Q9HBW0 2/20 0.40
PRKAB2 O43741 1/20 0.37
PRKAG1 P54619 1/20 0.37
PRKAA2 P54646 1/20 0.37
PRKAA1 Q13131 1/20 0.37
PRKAG3 Q9UGI9 1/20 0.37
PRKAG2 Q9UGJ0 1/20 0.37
PRKAB1 Q9Y478 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
SCHEMBL5093706 0.93 MAPK14 (0.50) MAPK14MAPK11LPAR2
SCHEMBL5093937 0.90 MAPK14 (0.48) MAPK14MAPK11LPAR2
SCHEMBL14015108 0.90 MAPK14 (0.48) MAPK14MAPK11LPAR2
SCHEMBL5100028 0.90 MAPK14 (0.52) MAPK14MAPK11LPAR2
SCHEMBL5100225 0.89 MAPK14 (0.50) MAPK14MAPK11LPAR2
SCHEMBL5093585 0.88 MAPK14 (0.49) MAPK14MAPK11LPAR2
SCHEMBL5106561 0.87 MAPK14 (0.56) MAPK14MAPK11LPAR2
SCHEMBL5093743 0.86 MAPK14 (0.52) MAPK14MAPK11LPAR2
SCHEMBL5093673 0.85 MAPK14 (0.55) MAPK14MAPK11LPAR2
SCHEMBL5093650 0.85 MAPK14 (0.50) MAPK14MAPK11

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
US-7452880-B2 Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same F. HOFFMANN-LA ROCHE AG (CH) 2008-11-18 US claimed
US-7452880-B2 Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same F. HOFFMANN-LA ROCHE AG (CH) 2008-11-18 US disclosed
US-7452880-B2 Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same F. HOFFMANN-LA ROCHE AG (CH) 2008-11-18 US disclosed
US-7452880-B2 Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same F. HOFFMANN-LA ROCHE AG (CH) 2008-11-18 US disclosed
US-20050203091-A1 Heteroaryl-fused pyrazolo derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-15 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-20050203091-A1 Heteroaryl-fused pyrazolo derivatives and methods for using the same MAP3K1, MAP3K21, MAP3K2 MAPK14 48/4885MAPK11 58/4885LPAR2 952/4885

“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.