SCHEMBL2080188

SCHEMBL2080188

Cc1ccccc1-c1c2nc(N3CCN(C(=O)OC(C)(C)C)CC3)cc(-c3ccc(F)cc3F)c2cc[n+]1[O-]

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.52
BRD4 O60885 1/20 0.40
PDK2 Q15119 1/20 0.40
TP53 P04637 1/20 0.39
CKS1B P61024 2/20 0.38
SKP1 P63208 2/20 0.38
SKP2 Q13309 2/20 0.38
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 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
SCHEMBL2080062 0.92 MAPK14 (0.51) MAPK14BRD4PDK2MAPK13MAPK12
SCHEMBL2078094 0.89 MAPK14 (0.51) MAPK14BRD4MAPK13MAPK12MAPK11
SCHEMBL2078753 0.87 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2079311 0.86 MAPK14 (0.53) MAPK14TP53
SCHEMBL2080015 0.85 ATR (0.47) MAPK14BRD4TP53CKS1BSKP1
SCHEMBL2080704 0.82 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4250272 0.80 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4395599 0.79 ATR (0.46) BRD4CKS1BSKP1SKP2
SCHEMBL2079685 0.78 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4070232 0.78 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11

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-7906530-B2 1,7-naphthyridine derivatives as p38 MAP kinase inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2011-03-15 US disclosed
US-20100227881-A1 1,7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2010-09-09 US disclosed
EP-2049537-A1 1, 7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS Laboratorios Almirall, S.A. (ES) 2009-04-22 EP disclosed
WO-2008017461-A1 1, 7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2008-02-14 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-20100227881-A1 1,7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS MAPK1, MAPK7, MAPKAPK2 MAPK14 23/4885BRD4 1777/4885PDK2 266/4885

“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.