SCHEMBL8499428

SCHEMBL8499428

CCCc1cccc(C)c1OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 2/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ENPP1 P22413 1/20 0.41
ALPI P09923 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
ALDH1A1 P00352 2/20 0.38
DRD2 P14416 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
DRD5 P21918 1/20 0.38
DRD3 P35462 1/20 0.38
HTT P42858 2/20 0.38
CNR2 P34972 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
DHODH Q02127 2/20 0.36

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
SCHEMBL3842864 0.87 MEN1 (0.48) MEN1KMT2AGAAESR1ESR2
SCHEMBL21806584 0.84 PTGER4 (0.50) MEN1KMT2AGAAESR1ESR2
SCHEMBL6935683 0.83 KMT2A (0.51) MEN1KMT2AGAAESR1ESR2
SCHEMBL8502387 0.83 DHODH (0.38) MEN1KMT2AGAAESR1ESR2
SCHEMBL11214677 0.83 MEN1 (0.40) MEN1KMT2AGAAESR1ESR2
SCHEMBL8502389 0.82 LMNA (0.41) MEN1KMT2AGAAESR1ESR2
SCHEMBL15442919 0.76 KMT2A (0.46) MEN1KMT2AGAAESR1ESR2
SCHEMBL15249774 0.74 KMT2A (0.42) MEN1KMT2AGAAESR1ESR2
SCHEMBL3839443 0.74 MEN1 (0.43) MEN1KMT2AGAAESR1ESR2
SCHEMBL21806579 0.74 LMNA (0.48) MEN1KMT2AGAAESR1ESR2

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-0956312-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR Corporation (JP) 1999-11-17 EP disclosed
WO-1998033836-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR CORPORATION (JP) 1998-08-06 WO disclosed