SCHEMBL8660195

SCHEMBL8660195

Cc1ccc(-c2cc(F)c(F)cc2NS(=O)(=O)c2ccccc2)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.47
STAT3 P40763 1/20 0.45
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 2/20 0.43
FFAR4 Q5NUL3 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.42
KIF11 P52732 1/20 0.41
SLC40A1 Q9NP59 1/20 0.41
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
TP53 P04637 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
SCHEMBL8661264 0.91 STAT3 (0.45) MCL1STAT3ALDH1A1KMT2ATSHR
SCHEMBL8663461 0.89 PGAM1 (0.48) STAT3FFAR4SLC40A1ALOX5APFEN1
SCHEMBL8660960 0.87 MCOLN3 (0.57) MCL1STAT3ALDH1A1KMT2ATSHR
SCHEMBL8659158 0.87 KIF11 (0.53) STAT3KMT2AFFAR4GAAKIF11
SCHEMBL8661208 0.87 STAT3 (0.52) MCL1STAT3ALDH1A1TSHRFFAR4
SCHEMBL8659786 0.87 PTGS2 (0.53) MCL1STAT3ALDH1A1TSHRFFAR4
SCHEMBL8659319 0.86 PGAM1 (0.47) STAT3TSHRFFAR4MAPTSLC40A1
SCHEMBL8659727 0.85 STAT3 (0.50) STAT3ALDH1A1KMT2AMAPTL3MBTL1
SCHEMBL8659075 0.84 TSHR (0.56) MCL1STAT3ALDH1A1TSHRFFAR4
SCHEMBL8657426 0.84 SCN9A (0.46) STAT3KMT2ATSHRFFAR4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739166-A ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT G.D. SEARLE & CO. (US) 1998-04-14 US disclosed