SCHEMBL12597250

SCHEMBL12597250

Bc1ccc2nc(Cc3nnc(CC(=O)OC(C)(C)C)o3)ccc2c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 3/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MTNR1A P48039 5/20 0.34
▸ MTNR1B P49286 5/20 0.34
▸ APLNR P35414 1/20 0.33
▸ HDAC6 Q9UBN7 2/20 0.31
▸ GRM1 Q13255 1/20 0.30
▸ RIPK1 Q13546 1/20 0.30
▸ RIPK3 Q9Y572 1/20 0.30

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
SCHEMBL12940717 0.87 LIPG (0.45) LIPGSMN1; SMN2MTNR1AMTNR1BAPLNR
SCHEMBL12597433 0.79 MTNR1A (0.41) SMN1; SMN2MTNR1AMTNR1BAPLNRHDAC6
SCHEMBL12597246 0.76 CYSLTR1 (0.34) —
SCHEMBL12940754 0.69 LIPG (0.48) LIPG
SCHEMBL12941831 0.69 MTNR1A (0.41) SMN1; SMN2MTNR1AMTNR1BAPLNRHDAC6
SCHEMBL12597249 0.69 CYSLTR2 (0.44) —
SCHEMBL12596664 0.68 LIPG (0.45) LIPGMTNR1AMTNR1B
SCHEMBL12597437 0.68 MEN1 (0.49) LIPGSMN1; SMN2MTNR1AMTNR1BHDAC6
SCHEMBL12940876 0.68 LIPG (0.57) LIPG
SCHEMBL12597422 0.68 LIPG (0.67) LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011074560-A1 OXADIAZOLE DERIVATIVE HAVING ENDOTHELIAL LIPASE INHIBITORY ACTIVITY 塩野義製薬株式会社 (JP) 2011-06-23 — — WO disclosed
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