SCHEMBL9899112

SCHEMBL9899112

CCC(=O)C(=N\OCc1ccccc1)/C(C)=N/OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
PPARG P37231 3/20 0.43
PPARA Q07869 2/20 0.43
ALOX5 P09917 1/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAOB P27338 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
HPGD P15428 1/20 0.38
CA2 P00918 2/20 0.38
S1PR1 P21453 1/20 0.38
CA9 Q16790 1/20 0.38
CA1 P00915 1/20 0.37
PTGS2 P35354 1/20 0.37
LMNA P02545 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
SCHEMBL9899114 1.00 ALDH1A1 (0.45) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL9898661 0.89 ALDH1A1 (0.49) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL9898660 0.89 ALDH1A1 (0.49) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL9898923 0.86 ALDH1A1 (0.46) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL9898921 0.86 ALDH1A1 (0.46) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL2051947 0.83 L3MBTL1 (0.40) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL2051948 0.83 L3MBTL1 (0.40) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL934854 0.80 ALOX5 (0.56) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL934853 0.80 ALOX5 (0.56) ALDH1A1PPARGPPARAALOX5NPC1
SCHEMBL1629181 0.80 ALDH1A1 (0.53) ALDH1A1PPARGPPARAALOX5NPC1

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
US-8748531-B2 Polymers functionalized with oxime compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2014-06-10 US claimed
EP-2649102-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP Bridgestone Corporation (JP) 2013-10-16 EP claimed
US-20120149833-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 US claimed
WO-2012078962-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 WO claimed
EP-2649102-B1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORP (JP) 2014-11-26 EP disclosed
US-8748531-B2 Polymers functionalized with oxime compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2014-06-10 US disclosed
US-20120149833-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 US disclosed