SCHEMBL7708768

SCHEMBL7708768

Cc1ccc([S+](C)C)cc1.O=S(=O)([O-])C(F)(F)C(F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.35
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA5A P35218 2/20 0.33
CA9 Q16790 2/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.32
KCNH2 Q12809 1/20 0.32
GPR3 P46089 1/20 0.31
CA12 O43570 1/20 0.31
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA7 P43166 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
TLR9 Q9NR96 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
SCHEMBL7702833 0.89 AGER (0.36) AGERCA1CA2CA5ACA9
SCHEMBL7708749 0.84 GPR3 (0.35) AGERCA1CA2CA5ACA9
SCHEMBL7702718 0.84 GPR3 (0.35) AGERCA1CA2CA5ACA9
Trifluoromethanesulfonic Acid SCHEMBL562050 0.82 GPR3 (0.43) AGERCA1CA2CA5ACA9
Toliodium SCHEMBL7708774 0.80 AGER (0.36) AGERCA1CA2CA5ACA9
SCHEMBL7711459 0.76 LMNA (0.44) LMNAHPGDHTT
SCHEMBL7708455 0.75 GPR3 (0.35) AGERCA1CA2CA5ACA9
SCHEMBL7708812 0.75 ALDH1A1 (0.34) CA1CA2CA5ACA9KCNH2
SCHEMBL7708183 0.75 ALDH1A1 (0.38) CA1CA2CA9LMNAHPGD
SCHEMBL5858659 0.74 TLR9 (0.34) CA1CA2CA5ACA9GAA

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed