SCHEMBL2217849

SCHEMBL2217849

CCNC(=O)c1ccc(C)c(-c2cc3[nH]nc(-c4cccc(F)c4)c3cn2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 10/20 0.46
CLK2 P49760 2/20 0.42
CLK3 P49761 2/20 0.42
DYRK1A Q13627 2/20 0.42
DDR2 Q16832 4/20 0.41
FGFR1 P11362 3/20 0.41
MAP2K4 P45985 1/20 0.41
CDK8 P49336 1/20 0.41
TTK P33981 1/20 0.41
WNT1 P04628 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
SCHEMBL2217549 0.91 MAPK1 (0.48) MAPK1DDR2FGFR1
SCHEMBL2217291 0.88 LRRK2 (0.44) MAPK1FGFR1
SCHEMBL2215978 0.86 MAPK1 (0.45) MAPK1DDR2FGFR1
SCHEMBL2216227 0.85 MAPT (0.42) DDR2FGFR1MAP2K4CDK8TTK
SCHEMBL2214118 0.84 MAPK1 (0.46) MAPK1MAP2K4
SCHEMBL2217969 0.82 TRPA1 (0.56) MAPK1
SCHEMBL2216481 0.80 PARP1 (0.43) MAPK1
SCHEMBL2217307 0.78 MAPK1 (0.57) MAPK1
SCHEMBL4219480 0.78 DDR2 (0.51) MAPK1DYRK1ADDR2FGFR1MAP2K4
SCHEMBL2216159 0.77 PARP1 (0.44) MAPK1

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
EP-1709046-B1 P38 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-07-27 EP disclosed
EP-1709046-B1 P38 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-07-27 EP disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 US disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 US disclosed
US-20070161673-A1 P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2007-07-12 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 (1 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-20070161673-A1 P38 kinase inhibitors MAPK1, MAPK7, MAP3K1 MAPK1 1/4885CLK2 972/4885CLK3 1976/4885

“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.