SCHEMBL4677221

SCHEMBL4677221

COc1ccc(C(c2ccc(OC)cc2)N2C(=O)[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H]2c2ncccc2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
HKDC1 Q2TB90 1/20 0.34
NFE2L2 Q16236 1/20 0.34
KAT2B Q92831 1/20 0.33
BRAF P15056 1/20 0.33
CYP19A1 P11511 2/20 0.32
GPR139 Q6DWJ6 2/20 0.32
PPARG P37231 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD11B1 P28845 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 2/20 0.31
PDE2A O00408 2/20 0.31
TSHR P16473 1/20 0.31
SHMT2 P34897 1/20 0.31
CACNA1B Q00975 1/20 0.31

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
SCHEMBL4675287 0.85 KDM4E (0.36) KDM4EHKDC1NFE2L2BRAFCYP19A1
SCHEMBL4675295 0.85 KDM4E (0.36) KDM4EHKDC1NFE2L2BRAFCYP19A1
SCHEMBL4671531 0.85 KDM4E (0.36) KDM4EHKDC1NFE2L2BRAFCYP19A1
SCHEMBL6721749 0.84 NPSR1 (0.41) KDM4EHKDC1NFE2L2KAT2BALDH1A1
SCHEMBL4671613 0.84 NPSR1 (0.41) KDM4EHKDC1NFE2L2KAT2BALDH1A1
SCHEMBL4674838 0.83 KDM4E (0.41) KDM4EHKDC1NFE2L2KAT2BBRAF
SCHEMBL4673211 0.83 KDM4E (0.41) KDM4EHKDC1NFE2L2KAT2BBRAF
SCHEMBL13417830 0.79 ADORA3 (0.38)
SCHEMBL4174183 0.75 GRM5 (0.34) ALDH1A1MEN1KMT2AMAPT
SCHEMBL2447629 0.73 GRM5 (0.37)

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-1375495-B1 METHOD FOR PRODUCING A 2-AZETIDINONE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2008-09-03 EP disclosed
US-7126003-B2 Method for producing 2-azetidinone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-10-24 US disclosed
US-20040072309-A1 Method for producing 2-azetidinone derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2004-04-15 US disclosed
EP-1375495-A1 METHOD FOR PRODUCING 2-AZETIDINONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-01-02 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-20040072309-A1 Method for producing 2-azetidinone derivative CYP51A1, AZI2, POR KDM4E 1139/4885HKDC1 2326/4885NFE2L2 776/4885

“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.