SCHEMBL9898514

SCHEMBL9898514

O=C(CCC(=NOS(=O)(=O)c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.50
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.46
CYP2C19 P33261 1/20 0.46
NR4A2 P43354 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KMT2A Q03164 2/20 0.42
PPARA Q07869 2/20 0.41
PPARG P37231 1/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CTNNB1 P35222 1/20 0.41
WNT3A P56704 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
SCHEMBL9898511 1.00 HSD11B1 (0.50) HSD11B1ALDH1A1GAACYP2C19NR4A2
SCHEMBL2050856 0.92 MAPT (0.51) HSD11B1ALDH1A1KDM4EMAPTLMNA
SCHEMBL2050857 0.92 MAPT (0.51) HSD11B1ALDH1A1KDM4EMAPTLMNA
SCHEMBL9898803 0.92 HSD11B1 (0.48) HSD11B1ALDH1A1GAACYP2C19NR4A2
SCHEMBL9898800 0.92 HSD11B1 (0.48) HSD11B1ALDH1A1GAACYP2C19NR4A2
SCHEMBL2051908 0.86 KDM4E (0.49) HSD11B1ALDH1A1GAAKDM4EMAPT
SCHEMBL2051909 0.86 KDM4E (0.49) HSD11B1ALDH1A1GAAKDM4EMAPT
SCHEMBL2045835 0.84 MAPT (0.47) ALDH1A1KDM4EMAPTLMNATDP1
SCHEMBL2045836 0.84 MAPT (0.47) ALDH1A1KDM4EMAPTLMNATDP1
SCHEMBL9899206 0.84 HSD11B1 (0.49) HSD11B1ALDH1A1GAACYP2C19NR4A2

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