SCHEMBL7057650

SCHEMBL7057650

CC(C)(C)c1ccc([S+]2CCCCC2)cc1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
ACHE P22303 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CA1 P00915 4/20 0.32
CA2 P00918 4/20 0.32
RORA P35398 1/20 0.32
HSD11B1 P28845 6/20 0.31
MAPT P10636 2/20 0.30
HPGD P15428 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
NPC1 O15118 1/20 0.30
GMNN O75496 1/20 0.30
DRD1 P21728 1/20 0.30
DRD3 P35462 1/20 0.30
CCR2 P41597 1/20 0.30
RAB9A P51151 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7055117 0.99 LMNA (0.37) LMNAGAAACHEALDH1A1CA1
SCHEMBL7052417 0.99 LMNA (0.40) LMNAGAAACHEALDH1A1CA1
SCHEMBL7059010 0.97 LMNA (0.38) LMNAGAAACHEALDH1A1CA1
SCHEMBL5433859 0.86 ALDH1A1 (0.35) GAAACHEALDH1A1CA1CA2
SCHEMBL5439039 0.84 ALDH1A1 (0.35) GAAACHEALDH1A1CA1CA2
SCHEMBL7055556 0.84 HTT (0.38) GAAALDH1A1CA1CA2HSD11B1
Trifluoromethanesulfonic Acid SCHEMBL7053442 0.84 ACHE (0.40) LMNAGAAACHEALDH1A1RORA
SCHEMBL2901096 0.83 CA2 (0.35) CA1CA2
SCHEMBL2901807 0.83 CA2 (0.35) CA1CA2
SCHEMBL5357438 0.82 GAA (0.36) GAAALDH1A1CA1CA2HSD11B1

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-20030134227-A1 Cyclic sulfonium and sulfoxonium photoacid generators and photoresists comprising same SHIPLEY COMPANY, LLC 2003-07-17 US disclosed
EP-1308781-A2 Cyclic sulfonium and sulfoxonium photoacid generators and photoresists containing them Shipley Co. L.L.C. (US) 2003-05-07 EP disclosed