SCHEMBL8501653

SCHEMBL8501653

CC=Cc1cc(C(F)C(F)(F)C(F)(F)F)ccc1OS(=O)(=O)c1ccccc1C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
ESR1 P03372 2/20 0.37
KMT2A Q03164 2/20 0.37
ESR2 Q92731 2/20 0.37
GAA P10253 1/20 0.37
ATM Q13315 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTR6 P50406 1/20 0.33
POLB P06746 1/20 0.32
HSD11B1 P28845 1/20 0.31

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
SCHEMBL7465006 0.86 ALDH1A1 (0.41) MEN1KMT2AGAA
SCHEMBL7475145 0.86 MEN1 (0.41) MEN1ESR1KMT2AESR2GAA
SCHEMBL8502135 0.81 CYP1A2 (0.40) MEN1ESR1KMT2AESR2GAA
SCHEMBL7466063 0.81 CXCR2 (0.33)
SCHEMBL3840697 0.81 MEN1 (0.39) MEN1ESR1KMT2AESR2GAA
SCHEMBL3838736 0.78 MEN1 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL8501139 0.76 MEN1 (0.39) MEN1ESR1KMT2AESR2GAA
SCHEMBL3840935 0.75 MEN1 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL3846211 0.75 CYP1A2 (0.40) MEN1ESR1KMT2AESR2GAA
SCHEMBL8502271 0.74 CYP1A2 (0.42) MEN1ESR1KMT2AESR2GAA

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