SCHEMBL2078751

SCHEMBL2078751

COc1ccccc1-c1ccnc2c(-c3c(F)cccc3F)nccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.65
MAP4K1 Q92918 2/20 0.42
UGCG Q16739 3/20 0.41
IDO1 P14902 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TDO2 P48775 1/20 0.39
SYK P43405 1/20 0.39
CCNT1 O60563 1/20 0.38
CDK9 P50750 1/20 0.38
ATR Q13535 1/20 0.38
ATRIP Q8WXE1 1/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
FYN P06241 1/20 0.38
KCNN4 O15554 1/20 0.38
RPS6KA2 Q15349 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
SCHEMBL2079054 0.86 MAPK14 (0.51) MAPK14UGCGCYP1A2CYP3A4CYP2D6
SCHEMBL2079875 0.80 MAPK14 (0.66) MAPK14UGCGIDO1CYP1A2CYP3A4
SCHEMBL2079342 0.80 MAPK14 (0.66) MAPK14UGCGCCNT1CDK9ATR
SCHEMBL4072292 0.79 MAPK14 (0.45) MAPK14IDO1CCNT1CDK9
SCHEMBL2080727 0.77 MAPK14 (0.62) MAPK14ATRATRIP
SCHEMBL4067939 0.76 MAPK14 (0.60) MAPK14MAP4K1UGCGIDO1TDO2
SCHEMBL4236343 0.72 APP (0.53) MAPK14MAP4K1ALDH1A1SYKUSP2
SCHEMBL29983606 0.71 ALDH1A1 (0.51) MAPK14UGCGIDO1CYP1A2CYP3A4
SCHEMBL30365370 0.70 MAPK14 (0.55) MAPK14CCNT1CDK9
SCHEMBL2079261 0.69 MAPK14 (0.65) MAPK14CYP1A2ATRATRIP

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 6 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
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 23/4885MAP4K1 11/4885UGCG 2172/4885

“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.