SCHEMBL2079175

SCHEMBL2079175

CC(C)(C)OC(=O)N1CCN(c2cc(-c3ccc(F)cc3F)c3ccnc(-c4c(Cl)cccc4Cl)c3n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATR Q13535 9/20 0.46
ATRIP Q8WXE1 7/20 0.46
CKS1B P61024 2/20 0.41
SKP1 P63208 2/20 0.41
SKP2 Q13309 2/20 0.41
MAP4K4 O95819 1/20 0.40
SUV39H2 Q9H5I1 1/20 0.40
LMNA P02545 1/20 0.39
GRIA1 P42261 1/20 0.39
RORC P51449 1/20 0.39
CCNT1 O60563 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CDK9 P50750 1/20 0.39
CCNA1 P78396 1/20 0.39
FAAH O00519 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL2080810 0.93 ATR (0.48) ATRATRIPCKS1BSKP1SKP2
SCHEMBL4395599 0.92 ATR (0.46) ATRATRIPCKS1BSKP1SKP2
SCHEMBL2080015 0.87 ATR (0.47) ATRATRIPCKS1BSKP1SKP2
SCHEMBL2078410 0.86 GPR119 (0.42) LMNARORCCCNT1
SCHEMBL2080714 0.86 CCNT1 (0.51) LMNARORCCCNT1CCNA2CDK2
SCHEMBL2078753 0.84 MAPK14 (0.52)
SCHEMBL2078868 0.81 ATR (0.56) ATRATRIP
SCHEMBL2080062 0.79 MAPK14 (0.51) CNR1CNR2
SCHEMBL2078674 0.79 CCNT1 (0.48) LMNACCNT1CCNA2CDK2CDK9
SCHEMBL2079602 0.78 CCNT1 (0.49) LMNACCNT1CCNA2CDK2CDK9

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 ATR 906/4885ATRIP 1675/4885CKS1B 363/4885

“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.