SCHEMBL9899530

SCHEMBL9899530

CO/N=C1\CC(=O)CC(C)(C)C1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
ALOX15 P16050 1/20 0.50
GAA P10253 8/20 0.44
MAPT P10636 4/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 2/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAOA P21397 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
SCHEMBL9899532 1.00 ALDH1A1 (0.50) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL2050442 0.85 ALDH1A1 (0.32) ALDH1A1ALOX15
SCHEMBL2050441 0.85 ALDH1A1 (0.32) ALDH1A1ALOX15
SCHEMBL9899132 0.79 ALDH1A1 (0.46) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL9899134 0.79 ALDH1A1 (0.46) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL9897891 0.78 ALDH1A1 (0.53) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL9897890 0.78 ALDH1A1 (0.53) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL8509001 0.75 ALDH1A1 (0.58) ALDH1A1ALOX15GAAMAPTKMT2A
SCHEMBL9900349 0.73
SCHEMBL9899973 0.73

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