SCHEMBL4049398

SCHEMBL4049398

CCOC(=O)CCc1cccc(-n2nc(-c3ccccc3)cc2NC(=O)Nc2ccc(Cl)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.60
MAPK14 Q16539 7/20 0.55
KCNJ6 P48051 3/20 0.52
KCNJ3 P48549 3/20 0.52
KCNJ5 P48544 2/20 0.52
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GRM5 P41594 3/20 0.49
DDR2 Q16832 2/20 0.49
MAPK9 P45984 1/20 0.49
MAPK13 O15264 1/20 0.49
MAPK12 P53778 1/20 0.49
MAPK11 Q15759 1/20 0.49
POLB P06746 1/20 0.48
SRC P12931 1/20 0.46
TP53 P04637 1/20 0.45
SOAT2 O75908 1/20 0.45
SOAT1 P35610 1/20 0.45

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
SCHEMBL4052037 0.89 MAPK14 (0.59) MAPK14KCNJ6KCNJ3KCNJ5MAPT
SCHEMBL4048881 0.86 MAPK14 (0.56) PTPN1MAPK14KCNJ6KCNJ3KCNJ5
SCHEMBL3295232 0.86 MAPK14 (0.75) MAPK14DDR2MAPK9MAPK13MAPK12
SCHEMBL4055743 0.85 MAPK14 (0.64) MAPK14KCNJ6KCNJ3KCNJ5DDR2
SCHEMBL16317159 0.84 MAPK14 (0.54) PTPN1MAPK14KCNJ6KCNJ3KCNJ5
SCHEMBL4055653 0.81 PTPN1 (0.67) PTPN1MAPK14KCNJ6KCNJ3KCNJ5
SCHEMBL13576977 0.80 PTPN1 (0.72) PTPN1MAPK14KCNJ6KCNJ3KCNJ5
SCHEMBL3293954 0.77 MAPK14 (0.62) MAPK14DDR2MAPK9MAPK13MAPK12
SCHEMBL2081795 0.77 MAPK14 (0.79) MAPK14DDR2MAPK9MAPK13MAPK12
SCHEMBL5189629 0.77 KCNJ6 (0.49) MAPK14KCNJ6KCNJ3KCNJ5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-1836173-A4 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS LLC (US) 2009-07-08 EP disclosed
EP-1836173-A2 ANTI-INFLAMMATORY MEDICAMENTS Deciphera Pharmaceuticals, LLC (US) 2007-09-26 EP 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
WO-2006081034-A2 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2006-08-03 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-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS ABL2, ABL1, PTK2 PTPN1 292/4885MAPK14 80/4885KCNJ6 4281/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 PTPN1 1275/4885MAPK14 29/4885KCNJ6 2415/4885

“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.