SCHEMBL2083294

SCHEMBL2083294

O=C(Nc1cccc(Cl)c1Cl)Nc1cc(-c2ccccc2F)nn1-c1ccc(CC(=O)N2CCC(O)C2)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.62
NTRK1 P04629 3/20 0.44
KCNJ6 P48051 1/20 0.42
KCNJ5 P48544 1/20 0.42
KCNJ3 P48549 1/20 0.42
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
EPHB2 P29323 1/20 0.41

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
SCHEMBL2083292 1.00 MAPK14 (0.62) MAPK14NTRK1KCNJ6KCNJ5KCNJ3
SCHEMBL14190152 0.92 MAPK14 (0.61) MAPK14RAF1BRAFEPHB2
SCHEMBL2082962 0.84 MAPK14 (0.73) MAPK14RAF1BRAFEPHB2
SCHEMBL2081655 0.84 MAPK14 (0.86) MAPK14RAF1BRAFEPHB2
SCHEMBL2082672 0.84 MAPK14 (0.75) MAPK14RAF1BRAFEPHB2
SCHEMBL2082669 0.84 MAPK14 (0.75) MAPK14RAF1BRAFEPHB2
SCHEMBL2083009 0.84 MAPK14 (0.75) MAPK14RAF1BRAFEPHB2
SCHEMBL2085034 0.80 MAPK14 (0.66) MAPK14RAF1BRAFEPHB2
SCHEMBL2083689 0.79 MAPK14 (0.72) MAPK14RAF1BRAFEPHB2
SCHEMBL2083691 0.79 MAPK14 (0.72) MAPK14RAF1BRAFEPHB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US claimed
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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 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 (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-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS ABL2, ABL1, PTK2 MAPK14 80/4885NTRK1 399/4885KCNJ6 4281/4885
US-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK MAPK14 128/4885NTRK1 210/4885KCNJ6 4192/4885
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 MAPK14 100/4885NTRK1 217/4885KCNJ6 3243/4885

“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.