SCHEMBL13296972

SCHEMBL13296972

COc1ccc(OC(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.59
MAPK13 O15264 5/20 0.59
MAPK12 P53778 5/20 0.59
MAPK11 Q15759 5/20 0.59
NTRK1 P04629 2/20 0.51
NTRK2 Q16620 1/20 0.51
PTK2B Q14289 1/20 0.49
CDK8 P49336 3/20 0.48
RECQL P46063 1/20 0.47
JAK2 O60674 1/20 0.47
MAPK9 P45984 2/20 0.47
DDR2 Q16832 1/20 0.47
HPGD P15428 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
SCHEMBL13296968 0.91 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL13296932 0.90 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL3296032 0.89 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL13296965 0.88 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1013743 0.87 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL1600192 0.86 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL13868671 0.83 CDK8 (0.53) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5089263 0.82 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11RECQL
SCHEMBL13296928 0.81 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL1599571 0.81 CDK8 (0.69) MAPK14MAPK13MAPK12MAPK11PTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090075986-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-03-19 US disclosed
US-20090075986-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-03-19 US disclosed
US-20080187978-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-08-07 US disclosed
US-20080187978-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-08-07 US disclosed
US-20080132506-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-06-05 US disclosed
US-20080132506-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2008-06-05 US disclosed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 US disclosed
US-20080064688-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-03-13 US disclosed
US-7342037-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-11 US disclosed
US-7342037-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2008-03-11 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 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 (5 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-20080064688-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MAPK14 56/4885MAPK13 144/4885MAPK12 77/4885
US-20090105230-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MAPK14 56/4885MAPK13 144/4885MAPK12 77/4885
US-20090075986-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MAPK14 56/4885MAPK13 144/4885MAPK12 77/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 MAPK14 29/4885MAPK13 41/4885MAPK12 37/4885
US-20080132506-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF MAPK14 56/4885MAPK13 144/4885MAPK12 77/4885

“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.