SCHEMBL1400007

SCHEMBL1400007

Cc1ccc(C(=O)NC2CC2)cc1-n1ccc2ccc(OCCCBr)cc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.54
RPS6KA5 O75582 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPKAPK2 P49137 1/20 0.46
KCNH2 Q12809 1/20 0.46
MAPK11 Q15759 1/20 0.46

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
SCHEMBL1400005 0.92 MAPK14 (0.55) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399817 0.91 MAPK14 (0.55) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399820 0.90 MAPK14 (0.57) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399765 0.90 MAPK14 (0.56) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399786 0.90 MAPK14 (0.52) MAPK14
SCHEMBL1399998 0.90 MAPK14 (0.54) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399851 0.89 MAPK14 (0.51) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399838 0.89 MAPK14 (0.53) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2
SCHEMBL1399868 0.88 MAPK14 (0.55) MAPK14
SCHEMBL1399927 0.88 MAPK14 (0.52) MAPK14RPS6KA5CYP3A4MAPKAPK2KCNH2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831174-B1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2011-03-02 EP disclosed
US-7786115-B2 Amide derivatives ASTRAZENECA AB (SE) 2010-08-31 US disclosed
US-20080146566-A1 Amide Derivatives ASTRAZENECA AB (SE) 2008-06-19 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-20080146566-A1 Amide Derivatives IL6, IL1B, IL1A MAPK14 2077/4885RPS6KA5 685/4885CYP3A4 234/4885

“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.