SCHEMBL9899601

SCHEMBL9899601

CC(C)(C)C1=CC(=NOS(=O)(=O)c2ccccc2)C(=O)C(C(C)(C)C)=C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.52
MAPT P10636 9/20 0.52
NPSR1 Q6W5P4 8/20 0.52
MPI P34949 7/20 0.52
RAB9A P51151 5/20 0.52
HSP90AA1 P07900 5/20 0.52
XBP1 P17861 5/20 0.52
LMNA P02545 5/20 0.52
S1PR2 O95136 3/20 0.52
OPRM1 P35372 1/20 0.52
OPRD1 P41143 1/20 0.52
PKM P14618 4/20 0.49
HTT P42858 3/20 0.49
TDP1 Q9NUW8 3/20 0.48
MAPK1 P28482 5/20 0.47
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
PAX8 Q06710 1/20 0.47
TP53 P04637 1/20 0.45
THRB P10828 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
SCHEMBL2045046 0.82 MAPT (0.44) ALDH1A1MAPTNPSR1MPIRAB9A
SCHEMBL9898853 0.76 ALDH1A1 (0.41) ALDH1A1MAPTNPSR1MPIRAB9A
SCHEMBL9897837 0.76 ALDH1A1 (0.41) ALDH1A1MAPTNPSR1MPIPKM
SCHEMBL9898752 0.75 ATM (0.53) ALDH1A1MAPTNPSR1MPIPKM
SCHEMBL9898611 0.71 ALDH1A1 (0.49) ALDH1A1MAPTNPSR1MPIPKM
SCHEMBL9899177 0.70 ALDH1A1 (0.47) ALDH1A1MAPTNPSR1MPIPKM
SCHEMBL31372901 0.69 ALDH1A1 (0.48) ALDH1A1MAPTNPSR1MPIRAB9A
SCHEMBL15299805 0.69 MAPT (0.69) ALDH1A1MAPTNPSR1MPIRAB9A
SCHEMBL15299765 0.69 MAPT (0.69) ALDH1A1MAPTNPSR1MPIRAB9A
SCHEMBL5160707 0.69 MAPT (0.69) ALDH1A1MAPTNPSR1MPIRAB9A

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