SCHEMBL7814243

SCHEMBL7814243

O=C(O)C1CCC(CCc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.54
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
S1PR1 P21453 1/20 0.49
S1PR5 Q9H228 1/20 0.49
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
LMNA P02545 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
HIF1A Q16665 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TAS2R14 Q9NYV8 1/20 0.45

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
SCHEMBL1609623 0.84 MAOA (0.58) MAOAMAOB
SCHEMBL15684283 0.84 S1PR1 (0.50) POLBMAOAMAOBL3MBTL1S1PR1
SCHEMBL16499815 0.82 ALDH1A1 (0.52) MAOAMAOBALDH1A1MAPT
SCHEMBL16499642 0.82 ALDH1A1 (0.52) MAOAMAOBALDH1A1MAPT
SCHEMBL16499644 0.82 ALDH1A1 (0.52) MAOAMAOBALDH1A1MAPT
SCHEMBL12449905 0.82 MAOA (0.50) MAOAMAOB
SCHEMBL1662783 0.81 GBA1 (0.53) POLBL3MBTL1ALDH1A1GAAPLG
SCHEMBL3515654 0.81 GBA1 (0.53) POLBL3MBTL1ALDH1A1GAAPLG
SCHEMBL10619913 0.81 S1PR3 (0.57) S1PR1S1PR5ALDH1A1MAPT
SCHEMBL10619909 0.81 S1PR3 (0.57) S1PR1S1PR5ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0681569-B1 SPIROCYCLOALKYL-SUBSTITUTED AZETIDINONES USEFUL AS HYPOCHOLESTEROLEMIC AGENTS SCHERING CORP (US) 2001-03-21 EP disclosed
US-5698548-A Spirocycloalkyl-substituted azetidinones useful as hypocholesterolemic agents SCHERING CORPORATION (US) 1997-12-16 US disclosed
CN-1118163-A Spirocycloalkyl-substituted azetidinones useful as hypocholesterolemic agents SCHERING CORP (US) 1996-03-06 CN disclosed