SCHEMBL2079416

SCHEMBL2079416

Fc1ccc(-c2cc(C3CCNCC3)nc3c(-c4c(Cl)cccc4Cl)nccc23)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 15/20 0.67
▸ MAPK13 O15264 1/20 0.59
▸ MAPK12 P53778 1/20 0.59
▸ MAPK11 Q15759 1/20 0.59
▸ CDK9 P50750 3/20 0.38
▸ CCNT1 O60563 2/20 0.38
▸ WNT1 P04628 1/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 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
SCHEMBL2079898 0.93 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL2079373 0.93 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL2079056 0.89 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL2079268 0.85 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL2079289 0.84 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL2080269 0.84 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11CDK9
SCHEMBL4076075 0.83 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4385651 0.83 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2081062 0.80 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2828324 0.80 MAPK14 (0.52) 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 8 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 claimed
US-20100227881-A1 1,7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2010-09-09 — — US claimed
EP-2049537-A1 1, 7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS Laboratorios Almirall, S.A. (ES) 2009-04-22 — — EP claimed
WO-2008017461-A1 1, 7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2008-02-14 — — WO claimed
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 23/4885MAPK13 38/4885MAPK12 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.

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