SCHEMBL305587

SCHEMBL305587

CCOC(=O)CCc1ccccc1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.56
CYP4A11 Q02928 3/20 0.56
POLB P06746 1/20 0.43
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
EPHX2 P34913 1/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 2/20 0.39
PTPN1 P18031 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PPID Q08752 1/20 0.38
HSD11B1 P28845 1/20 0.38
TOP2A P11388 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
SCHEMBL800069 0.85 CYP4F2 (0.51) CYP4F2CYP4A11POLBALDH1A1EPHX2
SCHEMBL9566303 0.82 NPSR1 (0.40) CYP4F2CYP4A11POLB
SCHEMBL25770231 0.82 POLB (0.45) CYP4F2CYP4A11POLBALDH1A1GAA
SCHEMBL16436925 0.80 TOP2A (0.44) CYP4F2CYP4A11POLBALDH1A1GAA
SCHEMBL2904671 0.79 ALDH1A1 (0.43) POLBALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL69660 0.78 CYP4F2 (0.86) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2
SCHEMBL9566270 0.78 CYP4A11 (0.40) CYP4F2CYP4A11ALDH1A1SMN1; SMN2MAPT
SCHEMBL25332285 0.78 POLB (0.41) CYP4F2CYP4A11POLBALDH1A1GAA
SCHEMBL5112147 0.77 FFAR4 (0.39) CYP4F2CYP4A11POLBGAAMAPT
SCHEMBL4822404 0.76 PDCD1 (0.34) CYP4F2CYP4A11GAASMN1; SMN2LMNA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160151322-A1 METALLO-B-LACTAMASE INHIBITORS MEIJI SEIKA KAISHA (JP) 2016-06-02 US disclosed
US-9260375-B2 Metallo-β-lactamase inhibitors MEIJI SEIKA KAISHA, LTD. (JP) 2016-02-16 US disclosed
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS CHIKAUCHI KEN (JP) 2012-03-22 US disclosed
US-8093294-B2 Bacterial infections; effective for recovering the activities of beta-lactam antibiotics; 2-ethyl-3-methylmaleic acid dimethyl ester; maleic acid derivatives and/or dihydrofuranyl derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2012-01-10 US disclosed
EP-1941873-A1 METALLO-BETA-LACTAMASE INHIBITOR MEIJI SEIKA KAISHA LTD. (JP) 2008-07-09 EP disclosed
US-20080090825-A1 Metallo-beta-lactamase inhibitors MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-17 US 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 (3 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-20080090825-A1 Metallo-beta-lactamase inhibitors ME1, MGAM, GAA CYP4F2 1625/4885CYP4A11 1497/4885POLB 385/4885
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS ME1, MGAM, GAA CYP4F2 1625/4885CYP4A11 1497/4885POLB 385/4885
US-20160151322-A1 METALLO-B-LACTAMASE INHIBITORS ME1, MGAM, MANBA CYP4F2 1614/4885CYP4A11 1459/4885POLB 247/4885

“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.