SCHEMBL304482

SCHEMBL304482

CCOC(=O)C(=C(Cc1ccc(OCC(=O)OC)cc1)C(=O)O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 3/20 0.39
ADRB2 P07550 2/20 0.39
ADRB1 P08588 2/20 0.39
ADRB3 P13945 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTGS2 P35354 1/20 0.38
ESR1 P03372 1/20 0.37
PSMB5 P28074 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL304483 0.83 PTGS2 (0.43) PPARDMEN1KMT2APOLBL3MBTL1
SCHEMBL304481 0.83 PTGS2 (0.43) PPARDMEN1KMT2APOLBL3MBTL1
SCHEMBL304236 0.78 L3MBTL1 (0.38) L3MBTL1ALDH1A1ADRB2ADRB1SMN1; SMN2
SCHEMBL304932 0.76 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL304933 0.76 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL800603 0.76 PTGS2 (0.43) PPARDMEN1KMT2APOLBL3MBTL1
SCHEMBL5551453 0.75 GAA (0.59) MEN1KMT2APOLBGAANPSR1
SCHEMBL10193656 0.74 LMNA (0.42) POLBADRB2ADRB1ADRB3
SCHEMBL304365 0.74 ALDH1A1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL305232 0.73 LMNA (0.41) POLBADRB2ADRB1ADRB3

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 PPARD 2171/4885MEN1 332/4885KMT2A 1979/4885
US-20120071457-A1 METALLO-BETA-LACTAMASE INHIBITORS ME1, MGAM, GAA PPARD 2171/4885MEN1 332/4885KMT2A 1979/4885
US-20160151322-A1 METALLO-B-LACTAMASE INHIBITORS ME1, MGAM, MANBA PPARD 2441/4885MEN1 339/4885KMT2A 1961/4885

“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.