SCHEMBL4339271

SCHEMBL4339271

Cc1cccc(-c2noc(NC(=O)CCc3ccccc3Cl)c2-c2ccncc2)c1C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.52
HSP90AA1 P07900 4/20 0.43
NOTUM Q6P988 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
MAPK11 Q15759 1/20 0.39

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
SCHEMBL4336216 0.93 MAPK14 (0.59) MAPK14HSP90AA1ALDH1A1MAPTSCN5A
SCHEMBL4331928 0.88 MAPK14 (0.67) MAPK14ALDH1A1
SCHEMBL4342438 0.86 MAPK14 (0.60) MAPK14HSP90AA1ALDH1A1MAPTMAPK9
SCHEMBL4341498 0.86 MAPK14 (0.54) MAPK14HSP90AA1
SCHEMBL4335487 0.84 MAPK14 (0.71) MAPK14HSP90AA1MAPK9MAPK10MAPK11
SCHEMBL4346666 0.83 MAPK14 (0.54) MAPK14HSP90AA1ALDH1A1MAPK9MAPK10
SCHEMBL4346797 0.83 MAPK14 (0.63) MAPK14SCN5ASCN9AMAPK9MAPK10
SCHEMBL4332754 0.82 MAPK14 (0.61) MAPK14HSP90AA1ALDH1A1MAPK9MAPK10
SCHEMBL4341812 0.82 MAPK14 (0.66) MAPK14MAPK9MAPK10
SCHEMBL4337503 0.81 MAPK14 (0.70) MAPK14HSP90AA1ALDH1A1MAPK9MAPK10

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 4 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
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 2550/4885NOTUM 4485/4885

“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.