SCHEMBL4330105

SCHEMBL4330105

COc1ccc(-c2noc(N)c2-c2ccncc2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.58
NPC1 O15118 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 2/20 0.54
MLYCD O95822 2/20 0.50
BCL9 O00512 1/20 0.46
CTNNB1 P35222 1/20 0.46
CA4 P22748 1/20 0.46
S1PR1 P21453 5/20 0.46
S1PR3 Q99500 2/20 0.45
HSP90AA1 P07900 1/20 0.44
PDE4A P27815 1/20 0.43
RAB9A P51151 2/20 0.42
MAPK9 P45984 1/20 0.41
MAPK10 P53779 1/20 0.41
MAPK11 Q15759 1/20 0.41

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
SCHEMBL4346693 0.90 MAPK14 (0.56) MAPK14NPC1SMN1; SMN2MAPTMLYCD
SCHEMBL4335625 0.88 MAPK14 (0.61) MAPK14NPC1SMN1; SMN2MAPTMLYCD
SCHEMBL1874890 0.85 MAPK14 (0.62) MAPK14NPC1SMN1; SMN2MAPTCA4
SCHEMBL4337249 0.82 MAPK14 (0.67) MAPK14NPC1MLYCDHSP90AA1RAB9A
SCHEMBL27744977 0.80 TP53 (0.60) MAPK14NPC1SMN1; SMN2MAPTMLYCD
SCHEMBL4346446 0.79 MAPK14 (0.62) MAPK14NPC1MLYCDCA4S1PR1
SCHEMBL4480878 0.78 MAPK14 (0.55) MAPK14NPC1SMN1; SMN2MLYCDHSP90AA1
SCHEMBL4341533 0.77 MAPK14 (0.72) MAPK14NPC1SMN1; SMN2MLYCDRAB9A
SCHEMBL4335666 0.77 MAPK14 (0.59) MAPK14NPC1MAPTMLYCDCA4
SCHEMBL4342443 0.76 MAPK14 (0.71) MAPK14MLYCDMAPK9MAPK10MAPK11

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 43/4885NPC1 4823/4885SMN1; SMN2 4589/4885

“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.