SCHEMBL4347355

SCHEMBL4347355

COc1ccc(-c2noc(NC(=O)C(C)c3ccc(Cl)cc3)c2-c2ccncc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 15/20 0.55
MLYCD O95822 1/20 0.52
MAPK14 Q16539 2/20 0.49
PTGS2 P35354 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
SCHEMBL4470225 0.89 HSP90AA1 (0.54) HSP90AA1MLYCDMAPK14
SCHEMBL4330151 0.85 HSP90AA1 (0.55) HSP90AA1MLYCDMAPK14
SCHEMBL4335618 0.84 HSP90AA1 (0.50) HSP90AA1MLYCDMAPK14PTGS2
SCHEMBL4334629 0.82 MLYCD (0.51) HSP90AA1MLYCDMAPK14PTGS2
SCHEMBL4347352 0.80 MAPK14 (0.63) HSP90AA1MAPK14PTGS2
SCHEMBL4521206 0.79 MLYCD (0.56) MLYCDMAPK14
SCHEMBL4330123 0.78 MLYCD (0.49) HSP90AA1MLYCDMAPK14
SCHEMBL1875649 0.78 MAPK14 (0.64) MLYCDMAPK14
SCHEMBL4337093 0.76 MAPK14 (0.50) HSP90AA1MLYCDMAPK14
SCHEMBL4334555 0.75 MAPK14 (0.65) HSP90AA1MAPK14PTGS2

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 HSP90AA1 2550/4885MLYCD 4475/4885MAPK14 43/4885

“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.