SCHEMBL2081709

SCHEMBL2081709

CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2)n(-c2cccc(CCN)c2)n1

nearest known ligand 0.84

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.84
DDR2 Q16832 4/20 0.62
SRC P12931 1/20 0.62
MAPK9 P45984 1/20 0.61
MAPK13 O15264 8/20 0.60
MAPK12 P53778 8/20 0.60
MAPK11 Q15759 8/20 0.60
RAF1 P04049 1/20 0.59
BRAF P15056 1/20 0.59
EPHB2 P29323 1/20 0.59

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
SCHEMBL2081936 0.93 MAPK14 (0.82) MAPK14DDR2SRCMAPK9MAPK13
SCHEMBL2083986 0.92 MAPK14 (1.00) MAPK14DDR2SRCMAPK9MAPK13
SCHEMBL2616996 0.90 MAPK14 (0.69) MAPK14DDR2SRCMAPK9MAPK13
SCHEMBL4049614 0.89 MAPK14 (0.75) MAPK14DDR2MAPK13MAPK12MAPK11
SCHEMBL13316172 0.88 MAPK14 (0.86) MAPK14DDR2SRCMAPK9MAPK13
SCHEMBL4055767 0.87 MAPK14 (0.73) MAPK14DDR2MAPK13MAPK12MAPK11
SCHEMBL4303575 0.87 MAPK14 (0.73) MAPK14DDR2MAPK13MAPK12MAPK11
SCHEMBL2083700 0.86 MAPK14 (0.64) MAPK14DDR2SRCMAPK9MAPK13
SCHEMBL2082836 0.84 MAPK14 (0.82) MAPK14MAPK11RAF1BRAFEPHB2
SCHEMBL2082240 0.84 MAPK14 (0.62) MAPK14DDR2SRCMAPK9MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163756-B2 For example,1-(3-t-butyl-1- (1,2,3,4-tetrahydro- isoquinolin-6-yl)-1H- pyrazol-5-yl)-3-(3- cyanophenyl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, LLC (US) 2012-04-24 US disclosed
US-8163756-B2 For example,1-(3-t-butyl-1- (1,2,3,4-tetrahydro- isoquinolin-6-yl)-1H- pyrazol-5-yl)-3-(3- cyanophenyl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, LLC (US) 2012-04-24 US disclosed
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US disclosed
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US disclosed
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US disclosed
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US disclosed
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 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-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 US disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 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 (4 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-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS ABL2, ABL1, PTK2 MAPK14 80/4885DDR2 888/4885SRC 4/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 MAPK14 29/4885DDR2 2382/4885SRC 232/4885
US-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK MAPK14 128/4885DDR2 1099/4885SRC 9/4885
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 MAPK14 100/4885DDR2 1256/4885SRC 69/4885

“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.