SCHEMBL4337134

SCHEMBL4337134

CC(=O)Nc1onc(-c2ccc(C)o2)c1-c1ccncc1.c1cc2cc-2c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.56
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
ADORA3 P0DMS8 2/20 0.44
ADORA2A P29274 2/20 0.44
ADORA2B P29275 2/20 0.44
ADORA1 P30542 2/20 0.44
HSP90AA1 P07900 5/20 0.41
MAPT P10636 2/20 0.40
MLYCD O95822 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA7 P43166 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDR P35968 2/20 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
SCHEMBL4332741 0.86 MAPK14 (0.73) MAPK14HSP90AA1MLYCDCA1CA2
SCHEMBL4337133 0.79 MAPK14 (0.67) MAPK14PTGS1PTGS2MAPTALDH1A1
SCHEMBL4339552 0.79 MAPK14 (0.66) MAPK14ADORA3ADORA2AADORA2BADORA1
SCHEMBL4330085 0.78 MAPK14 (0.68) MAPK14PTGS1PTGS2MLYCDKDM4E
SCHEMBL4333545 0.77 MAPK14 (0.58) MAPK14PTGS1PTGS2ADORA3ADORA2A
SCHEMBL4337264 0.70 PTGS1 (0.55) MAPK14PTGS1PTGS2ADORA3ADORA2A
SCHEMBL6316904 0.67 ALDH1A1 (0.45) MAPK14ADORA3ADORA1HSP90AA1MAPT
SCHEMBL4335680 0.67 MAPK14 (0.70) MAPK14KDM4EALDH1A1
SCHEMBL4332793 0.67 MAPK14 (0.51) MAPK14MLYCDKDM4EALDH1A1
SCHEMBL17214835 0.66 NQO2 (0.76) MAPTKDM4EALDH1A1SMN1; SMN2

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 43/4885PTGS1 139/4885PTGS2 216/4885

“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.