SCHEMBL4330123

SCHEMBL4330123

COc1cc(-c2noc(NC(=O)C(C)c3ccccc3)c2-c2ccncc2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 3/20 0.49
MAPK14 Q16539 8/20 0.48
HSP90AA1 P07900 1/20 0.41
PAX8 Q06710 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
GRM4 Q14833 1/20 0.38

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
SCHEMBL4337093 0.85 MAPK14 (0.50) MLYCDMAPK14HSP90AA1PSEN1PSEN2
SCHEMBL4344006 0.83 MAPK14 (0.71) MAPK14PAX8MEN1KMT2A
SCHEMBL4521206 0.82 MLYCD (0.56) MLYCDMAPK14KMT2APSEN1PSEN2
SCHEMBL4330119 0.81 MAPK14 (0.72) MLYCDMAPK14HSP90AA1KMT2A
SCHEMBL4342451 0.81 MAPK14 (0.47) MLYCDMAPK14HSP90AA1MEN1KMT2A
SCHEMBL4337180 0.81 MAPK14 (0.52) MLYCDMAPK14MEN1KMT2A
SCHEMBL4338188 0.80 MAPK14 (0.51) MLYCDMAPK14HSP90AA1PSEN1PSEN2
SCHEMBL4333456 0.80 MLYCD (0.47) MLYCDMAPK14HSP90AA1MEN1KMT2A
SCHEMBL4335643 0.80 MAPK14 (0.50) MLYCDMAPK14HSP90AA1PSEN1PSEN2
SCHEMBL4470225 0.79 HSP90AA1 (0.54) MLYCDMAPK14HSP90AA1MEN1KMT2A

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

“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.