SCHEMBL12940717

SCHEMBL12940717

CC(C)(C)OC(=O)Cc1nnc(Cc2ccc3cc(Br)ccc3n2)o1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 2/20 0.45
▸ HDAC1 Q13547 4/20 0.39
▸ HDAC2 Q92769 4/20 0.39
▸ MTNR1A P48039 5/20 0.37
▸ MTNR1B P49286 5/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MAOA P21397 1/20 0.33
▸ BACE1 P56817 2/20 0.33
▸ APLNR P35414 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ HDAC6 Q9UBN7 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
SCHEMBL12597250 0.87 LIPG (0.45) LIPGMTNR1AMTNR1BSMN1; SMN2APLNR
SCHEMBL12940754 0.80 LIPG (0.48) LIPG
SCHEMBL12941831 0.79 MTNR1A (0.41) HDAC1MTNR1AMTNR1BSMN1; SMN2APLNR
SCHEMBL12940916 0.78 LIPG (0.41) LIPG
SCHEMBL12597728 0.77 LIPG (0.74) LIPGHDAC1HDAC2
SCHEMBL12967557 0.76 HDAC1 (0.45) HDAC1HDAC2SMN1; SMN2BACE1LMNA
SCHEMBL24745514 0.73 MTNR1A (0.41) MTNR1AMTNR1BRXFP1
SCHEMBL30121847 0.73 MTNR1A (0.41) MTNR1AMTNR1BRXFP1
SCHEMBL24745431 0.71 MTNR1A (0.41) MTNR1AMTNR1BSMN1; SMN2LMNARXFP1
SCHEMBL12596664 0.70 LIPG (0.45) LIPGMTNR1AMTNR1B

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 7 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-20140323722-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2014-10-30 — — US disclosed
US-8754113-B2 Oxadiazole derivative having endothelial lipase inhibitory activity SHIONOGI & CO., LTD. (JP) 2014-06-17 — — US 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
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 (2 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 LIPG 1/4885HDAC1 615/4885HDAC2 1522/4885
US-20140323722-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY LIPG, CEL, LPL LIPG 1/4885HDAC1 372/4885HDAC2 991/4885

“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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