SCHEMBL4336219

SCHEMBL4336219

O=C(Cc1ccccc1)Nc1onc(-c2c(F)cc(F)cc2F)c1-c1ccncc1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.77
MAPK9 P45984 1/20 0.44
MAPK10 P53779 1/20 0.44
MAPK11 Q15759 1/20 0.44
PRKACA P17612 1/20 0.43
ROCK1 Q13464 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
PPARG P37231 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NR2E3 Q9Y5X4 1/20 0.43
NCOR2 Q9Y618 1/20 0.43

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
SCHEMBL4334943 0.92 MAPK14 (0.77) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL4329197 0.90 MAPK14 (0.78) MAPK14POLB
SCHEMBL4333020 0.89 MAPK14 (0.76) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL4338184 0.88 MAPK14 (0.77) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL4337254 0.87 MAPK14 (0.65) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL1874198 0.87 MAPK14 (0.85) MAPK14MAPK9MAPK10MAPK11
SCHEMBL4332734 0.87 MAPK14 (0.87) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL4327728 0.87 MAPK14 (0.79) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL4340368 0.87 MAPK14 (0.73) MAPK14MAPK9MAPK10MAPK11PRKACA
SCHEMBL27765814 0.84 MAPK14 (0.72) MAPK14MAPK9MAPK10MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036905-B1 PYRIDYLISOXAZOLE DERIVATIVE ASKA PHARM CO LTD (JP) 2012-12-12 EP disclosed
CN-101472921-B Pyridylisoxazole derivative ASKA PHARM CO LTD 2012-10-10 CN disclosed
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
CN-101472921-A Pyridylisoxazole derivative ASKA PHARM CO LTD (JP) 2009-07-01 CN 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 43/4885MAPK9 35/4885MAPK10 65/4885

“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.