SCHEMBL4338156

SCHEMBL4338156

COc1ccc(-c2noc(NC(=O)Cc3ccccc3)c2-c2ccncc2)c(F)c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.65
HSP90AA1 P07900 5/20 0.47
PRKACA P17612 4/20 0.44
ROCK1 Q13464 4/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL4335671 0.91 MAPK14 (0.66) MAPK14HSP90AA1
SCHEMBL4342945 0.89 MAPK14 (0.65) MAPK14HSP90AA1
SCHEMBL1882909 0.89 MAPK14 (0.69) MAPK14PRKACAROCK1CYP3A4
SCHEMBL4333020 0.88 MAPK14 (0.76) MAPK14PRKACAROCK1
SCHEMBL4332019 0.86 MAPK14 (0.68) MAPK14
SCHEMBL4340368 0.86 MAPK14 (0.73) MAPK14PRKACAROCK1
SCHEMBL4335365 0.86 MAPK14 (0.76) MAPK14HSP90AA1
SCHEMBL27744892 0.85 MAPK14 (0.66) MAPK14PRKACAROCK1CYP3A4
SCHEMBL4503852 0.85 MAPK14 (0.64) MAPK14HSP90AA1
SCHEMBL4339734 0.85 MAPK14 (0.66) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207203-B2 Pyridylisoxazole derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2012-06-26 US disclosed
US-20090306145-A1 Pyridylisoxazole Derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 US disclosed
EP-2036905-A1 PYRIDYLISOXAZOLE DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2009-03-18 EP 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-20090306145-A1 Pyridylisoxazole Derivatives CNKSR1, MAPK1, MAPK3 MAPK14 43/4885HSP90AA1 2550/4885PRKACA 118/4885

“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.