SCHEMBL12967446

SCHEMBL12967446

CC(C)(C)OC(=O)CC(=O)NNC(=O)Cc1ccc(Br)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ L3MBTL1 Q9Y468 4/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ GLA P06280 1/20 0.48
▸ HTT P42858 1/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ LMNA P02545 3/20 0.45
▸ MAPT P10636 1/20 0.45
▸ EGFR P00533 1/20 0.43
▸ ERBB2 P04626 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL1431992 0.88 ALDH1A1 (0.50) ALDH1A1L3MBTL1KDM4EGLAHTT
SCHEMBL12597428 0.85 HTT (0.47) ALDH1A1L3MBTL1KDM4EHTTLMNA
SCHEMBL31048202 0.83 L3MBTL1 (0.44) ALDH1A1L3MBTL1KDM4EGLAKMT2A
SCHEMBL5533824 0.82 MTNR1A (0.46) ALDH1A1L3MBTL1KDM4EGLAKMT2A
SCHEMBL18673195 0.76 HPGD (0.54) ALDH1A1HTTKMT2AMEN1LMNA
SCHEMBL27099061 0.76 HTT (0.50) ALDH1A1KDM4EHTTLMNAHPGD
SCHEMBL2068949 0.75 GAA (0.49) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL4317497 0.75 HTT (0.49) ALDH1A1L3MBTL1KDM4EHTTLMNA
SCHEMBL13580096 0.75 HTT (0.49) ALDH1A1L3MBTL1KDM4EHTTLMNA
SCHEMBL4549800 0.75 KDM4E (0.54) ALDH1A1KDM4EHTTKMT2AMEN1

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-2514749-B1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY SHIONOGI & CO (JP) 2015-02-25 — — EP disclosed
US-8754113-B2 Oxadiazole derivative having endothelial lipase inhibitory activity SHIONOGI & CO., LTD. (JP) 2014-06-17 — — US disclosed
EP-2514749-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY Shionogi & Co., Ltd. (JP) 2012-10-24 — — EP disclosed
US-20120253040-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-10-04 — — 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 (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-20120253040-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY LIPG, LPL, CEL ALDH1A1 2861/4885L3MBTL1 266/4885KDM4E 845/4885

“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.

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