SCHEMBL4993355

SCHEMBL4993355

CCCCCc1ccc2cc([S+]3CCCC3)ccc2c1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.33
CA2 P00918 1/20 0.33
FUT7 Q11130 1/20 0.33
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
CTSD P07339 1/20 0.32
CTSE P14091 1/20 0.32
BCHE P06276 1/20 0.31
FAAH O00519 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
SCHEMBL4996573 0.99 KCNH2 (0.35) KCNH2CA2FUT7S1PR1S1PR3
SCHEMBL4996810 0.99 KCNH2 (0.35) KCNH2CA2FUT7S1PR1S1PR3
SCHEMBL4993905 0.99 KCNH2 (0.35) KCNH2CA2FUT7S1PR1S1PR3
SCHEMBL4996335 0.97 CA2 (0.32) CA2BCHE
SCHEMBL4993965 0.87 THRB (0.32)
SCHEMBL4994452 0.86 THRB (0.33) KCNH2
SCHEMBL4994481 0.86 THRB (0.33) KCNH2
SCHEMBL4994018 0.86 THRB (0.33) KCNH2
SCHEMBL4996693 0.85 TSHR (0.35) CA2
SCHEMBL446601 0.85 TSHR (0.37) CA2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371503-B2 Sulfonium salt compound, photoacid generator, and positive-tone radiation-sensitive resin composition JSR CORPORATION (JP) 2008-05-13 US disclosed
US-20060141383-A1 Sulfonium salts, radiation- sensitive acid generators, and positive radiator-sensitive resin compositions JSR CORPORATION (JP) 2006-06-29 US disclosed
EP-1586570-A1 SULFONIUM SALTS, RADIATION-SENSITIVE ACID GENERATORS, AND POSITIVE RADIATION-SENSITIVE RESIN COMPOSITIONS JSR Corporation (JP) 2005-10-19 EP disclosed