SCHEMBL8779442

SCHEMBL8779442

COC(=O)CCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD10 O75832 1/20 0.47
ALDH1A1 P00352 7/20 0.46
KMT2A Q03164 3/20 0.44
RAB9A P51151 1/20 0.44
STAT3 P40763 2/20 0.44
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL8779472 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL8779386 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL10412216 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL8427107 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL13446628 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL26639631 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL3464668 1.00 PSMD10 (0.47) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL7711901 0.94 PSMD10 (0.43) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL31615042 0.92 EPHX2 (0.42) PSMD10ALDH1A1KMT2ARAB9ASTAT3
SCHEMBL5556510 0.92 ALDH1A1 (0.43) PSMD10ALDH1A1KMT2ARAB9ASTAT3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507348-B1 Superoxide dismutase derivatives KURARAY CO (JP) 1997-07-09 EP disclosed
US-5360914-A Intermediates for superoxide dismutase derivatives KURARAY CO., LTD. (JP) 1994-11-01 US disclosed
US-5238837-A Antiinflammatory agents, antiulcer agents KURARAY CO., LTD. (JP) 1993-08-24 US disclosed
EP-0507348-A2 Superoxide dismutase derivatives KURARAY CO., LTD. (JP) 1992-10-07 EP disclosed