SCHEMBL9899313

SCHEMBL9899313

CC(CCC(=O)c1ccccc1)=NO[Si](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.46
CTNNB1 P35222 2/20 0.44
WNT3A P56704 2/20 0.44
ALDH1A1 P00352 4/20 0.42
CYP2C19 P33261 2/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
LMNA P02545 3/20 0.42
KMT2A Q03164 4/20 0.42
HPGD P15428 4/20 0.42
MEN1 O00255 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPK1 P28482 2/20 0.42
CYP3A4 P08684 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42
CES1 P23141 1/20 0.42
USP2 O75604 1/20 0.41

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
SCHEMBL9899312 1.00 NR4A2 (0.46) NR4A2CTNNB1WNT3AALDH1A1CYP2C19
SCHEMBL9899073 0.90 KMT2A (0.47) ALDH1A1CYP2C19MAPTL3MBTL1TDP1
SCHEMBL9899071 0.90 KMT2A (0.47) ALDH1A1CYP2C19MAPTL3MBTL1TDP1
SCHEMBL9898899 0.88 NR4A2 (0.49) NR4A2CTNNB1WNT3AALDH1A1CYP2C19
SCHEMBL9898898 0.88 NR4A2 (0.49) NR4A2CTNNB1WNT3AALDH1A1CYP2C19
SCHEMBL2050412 0.87 MAPT (0.39) ALDH1A1MAPTL3MBTL1LMNAMAPK1
SCHEMBL2050414 0.87 MAPT (0.39) ALDH1A1MAPTL3MBTL1LMNAMAPK1
SCHEMBL9900333 0.86 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1LMNAKMT2A
SCHEMBL9900330 0.86 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1LMNAKMT2A
SCHEMBL9898979 0.84 NR4A2 (0.47) NR4A2CTNNB1WNT3AALDH1A1CYP2C19

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 5 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
US-20120149833-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 US 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