SCHEMBL2082697

SCHEMBL2082697

NC(=O)Cc1cccc(-n2nc(C3CCCC3)cc2NC(=O)Nc2cccc(Nc3nccc(-c4cnoc4)n3)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.54
KCNJ6 P48051 14/20 0.46
KCNJ3 P48549 14/20 0.46
KCNJ5 P48544 11/20 0.46
DDR2 Q16832 1/20 0.42
ABL1 P00519 2/20 0.42
BCR P11274 2/20 0.42
PDGFRB P09619 1/20 0.42
SRC P12931 1/20 0.42
PDGFRA P16234 1/20 0.42
BRAF P15056 1/20 0.40

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
SCHEMBL2081458 0.87 MAPK14 (0.56) MAPK14DDR2ABL1SRCBRAF
SCHEMBL2081254 0.79 MAPK14 (0.54) MAPK14KCNJ6KCNJ3KCNJ5DDR2
SCHEMBL2085107 0.75 MAPK14 (0.63) MAPK14DDR2SRCBRAF
SCHEMBL2081278 0.72 MAPK14 (0.55) MAPK14KCNJ6KCNJ3KCNJ5DDR2
SCHEMBL2085078 0.71 MAPK14 (0.59) MAPK14KCNJ6KCNJ3KCNJ5
SCHEMBL2083348 0.71 MAPK14 (1.00) MAPK14KCNJ6KCNJ3KCNJ5DDR2
SCHEMBL2082746 0.71 MAPK14 (0.78) MAPK14ABL1BCRPDGFRBPDGFRA
SCHEMBL2081647 0.67 NPC1 (0.61) MAPK14KCNJ6KCNJ3KCNJ5DDR2
SCHEMBL2616946 0.66 MAPK14 (0.61) MAPK14DDR2SRCBRAF
SCHEMBL2083910 0.66 MAPK14 (0.56) MAPK14ABL1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1835934-A2 ENZYME MODULATORS AND TREATMENTS Deciphera Pharmaceuticals, LLC (US) 2007-09-26 EP claimed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 US claimed
WO-2006071940-A2 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-07-06 WO 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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US disclosed
EP-1835934-A2 ENZYME MODULATORS AND TREATMENTS Deciphera Pharmaceuticals, LLC (US) 2007-09-26 EP disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 US disclosed
WO-2006071940-A2 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-07-06 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 (2 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-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK MAPK14 128/4885KCNJ6 4192/4885KCNJ3 4273/4885
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 MAPK14 100/4885KCNJ6 3243/4885KCNJ3 3372/4885

“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.