SCHEMBL1875402

SCHEMBL1875402

CC(C)(C)OC(=O)N(OC(C)(C)C)c1nccc(-c2c(-c3cccc(OCc4ccccc4)c3)noc2N)n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.38
CYP3A4 P08684 2/20 0.38
BRAF P15056 2/20 0.38
JAK3 P52333 2/20 0.38
KCNH2 Q12809 2/20 0.38
ERBB4 Q15303 2/20 0.38
MAPK10 P53779 1/20 0.38
IGF1R P08069 10/20 0.38
GABRA5 P31644 1/20 0.36
JAK2 O60674 1/20 0.36
RAF1 P04049 1/20 0.36
ARAF P10398 1/20 0.36
KDR P35968 1/20 0.36
MAP2K2 P36507 1/20 0.36
FLT3 P36888 1/20 0.36
BACE1 P56817 1/20 0.35
MAPK14 Q16539 1/20 0.35
DHODH Q02127 2/20 0.34

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
SCHEMBL1883316 0.87 MAPK14 (0.44) EGFRCYP3A4BRAFJAK3KCNH2
SCHEMBL1876011 0.84 MAPK14 (0.40) CYP3A4MAPK14
SCHEMBL1875418 0.83 MAPK14 (0.52) MAPK10MAPK14
SCHEMBL1874241 0.79 POLB (0.40) CYP3A4MAPK10MAPK14
SCHEMBL1872450 0.74 EGFR (0.54) EGFRCYP3A4BRAFJAK3KCNH2
SCHEMBL1881585 0.72 MAPK14 (0.56) MAPK10MAPK14
SCHEMBL1875148 0.72 MAPK14 (0.51) MAPK10MAPK14
SCHEMBL1874168 0.71 MAPK14 (0.45) CYP3A4MAPK10MAPK14
SCHEMBL1877120 0.70 MAPK14 (0.52) IGF1RBACE1MAPK14
SCHEMBL1874664 0.68 MAPK14 (0.47) CYP3A4MAPK14

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-1832584-B1 PYRIMIDINYLISOXAZOLE DERIVATIVE ASKA PHARM CO LTD (JP) 2011-12-21 EP disclosed
US-7939536-B2 5-[(2-chlorophenyl)acetylamino]-3-(4-fluorophenyl)-4-(4-pyrimidinyl)isoxazole; p 38MAP kinase inhibitor; tumor necrosis factor, interleukin, or cyclooxygenase-II related diseases; antiinflammatory, anticarcinogenic, antidiabetic agent ASKA PHARMACEUTICAL CO., LTD. (JP) 2011-05-10 US disclosed
US-20080114003-A1 Pyrimidinylisoxazole Derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2008-05-15 US disclosed
EP-1832584-A1 PYRIMIDINYLISOXAZOL DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2007-09-12 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-20080114003-A1 Pyrimidinylisoxazole Derivatives MAPK3, MAPK7, MAP3K7 EGFR 1375/4885CYP3A4 1031/4885BRAF 105/4885

“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.