SCHEMBL7951897

SCHEMBL7951897

COC1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
TP53 P04637 1/20 0.60
HTT P42858 1/20 0.58
GAA P10253 1/20 0.58
HPGD P15428 1/20 0.58
CNR1 P21554 1/20 0.57
PKM P14618 1/20 0.55
PKLR P30613 1/20 0.55
HSD11B1 P28845 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.52
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL14699675 0.93 KMT2A (0.56) KMT2AMEN1TP53HTTGAA
SCHEMBL7955499 0.93 KMT2A (0.56) KMT2AMEN1TP53HTTGAA
SCHEMBL7944872 0.88 KMT2A (0.51) KMT2AMEN1TP53HTTGAA
SCHEMBL1677064 0.87 TP53 (0.60) KMT2AMEN1TP53HTTGAA
SCHEMBL1677163 0.86 KMT2A (0.58) KMT2AMEN1TP53HTTGAA
SCHEMBL18726870 0.85 ALDH1A1 (0.63) KMT2AMEN1TP53HTTGAA
SCHEMBL12727839 0.83 HTT (0.62) KMT2AMEN1TP53HTTGAA
SCHEMBL1676973 0.83 CNR1 (0.63) TP53HTTGAAHPGDCNR1
SCHEMBL1677094 0.82 TP53 (0.55) KMT2AMEN1TP53HTTGAA
SCHEMBL1677096 0.82 TP53 (0.55) KMT2AMEN1TP53HTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346820-B1 OXYCARBAMOYL COMPOUNDS AND THE USE THEREOF SHIONOGI & CO (JP) 2013-02-13 EP disclosed
WO-2009151152-A1 OXYCARBAMOYL COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2009-12-17 WO disclosed