SCHEMBL1399809

SCHEMBL1399809

COc1ccc2ccn(-c3cc(C(=O)NC4CC4)ccc3C)c(=O)c2c1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.60
HPGDS O60760 1/20 0.51
SMYD3 Q9H7B4 1/20 0.49

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
SCHEMBL1399817 0.88 MAPK14 (0.55) MAPK14
SCHEMBL1400005 0.87 MAPK14 (0.55) MAPK14
SCHEMBL1399765 0.87 MAPK14 (0.56) MAPK14
SCHEMBL1399820 0.87 MAPK14 (0.57) MAPK14
SCHEMBL1399813 0.87 MAPK14 (0.60) MAPK14
SCHEMBL1400007 0.86 MAPK14 (0.54) MAPK14
SCHEMBL1399998 0.86 MAPK14 (0.54) MAPK14
SCHEMBL1399971 0.86 MAPK14 (0.52) MAPK14
SCHEMBL1399843 0.86 MAPK14 (0.52) MAPK14
SCHEMBL1399718 0.86 MAPK14 (0.59) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831174-B1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2011-03-02 EP claimed
US-20080146566-A1 Amide Derivatives ASTRAZENECA AB (SE) 2008-06-19 US claimed
EP-1831174-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2007-09-12 EP claimed
WO-2006067444-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2006-06-29 WO claimed
EP-1831174-B1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2011-03-02 EP disclosed
US-20100234355-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2010-09-16 US disclosed
US-7786115-B2 Amide derivatives ASTRAZENECA AB (SE) 2010-08-31 US disclosed
EP-2035386-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES AstraZeneca AB (SE) 2009-03-18 EP disclosed
US-20080207596-A1 Novel compounds 329 MARTIN BARRIE 2008-08-28 US disclosed
US-20080146566-A1 Amide Derivatives ASTRAZENECA AB (SE) 2008-06-19 US disclosed
WO-2007149031-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2007-12-27 WO disclosed
EP-1831174-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2007-09-12 EP disclosed
WO-2006067444-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2006-06-29 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 (3 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 2077/4885HPGDS 442/4885SMYD3 3361/4885
US-20080207596-A1 Novel compounds 329 CCL11, IL2, IL1B MAPK14 1168/4885HPGDS 591/4885SMYD3 4375/4885
US-20100234355-A1 ISOQUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF CYTOKINE MEDIATED DISEASES IL2, IFNG, IL1B MAPK14 1073/4885HPGDS 305/4885SMYD3 4337/4885

“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.