SCHEMBL17420149

SCHEMBL17420149

COCCOCCc1ccc(S(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(c2ccc(CCOCCOC)cc2)c2ccc(CCOCCOC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.53
CA2 P00918 13/20 0.53
RORC P51449 1/20 0.33
F2 P00734 2/20 0.32
TMPRSS4 Q9NRS4 2/20 0.32
AOC2 O75106 1/20 0.32
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL8514115 0.86 AOC2 (0.41) CA1CA2RORCAOC2TSHR
SCHEMBL454991 0.75 HSD11B1 (0.48) CA1CA2TP53
SCHEMBL3183463 0.75 CA2 (0.47) CA1CA2RORCF2
SCHEMBL271339 0.75 CA1 (0.44) CA1CA2
SCHEMBL503836 0.74 HSD11B1 (0.47) CA1CA2TP53
SCHEMBL562808 0.74 CA1 (0.46) CA1CA2
SCHEMBL1802639 0.73 CA1 (0.46) CA1CA2
SCHEMBL1593302 0.73 CA2 (0.40) CA1CA2RORC
SCHEMBL6310046 0.73 CA1 (0.49) CA1CA2CYP1A2CYP2D6TSHR
SCHEMBL51946 0.72 CA1 (0.43) CA1CA2

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
US-9354523-B2 Composition for resist pattern-refinement, and fine pattern-forming method JSR CORPORATION (JP) 2016-05-31 US disclosed
US-20160011513-A1 COMPOSITION FOR FORMING FINE RESIST PATTERN, AND FINE PATTERN-FORMING METHOD JSR CORPORATION (JP) 2016-01-14 US disclosed