SCHEMBL2701828

SCHEMBL2701828

O=S(=O)(F)C(F)(F)F.O=S(=O)(F)C(F)(F)F.O=S(=O)(F)C(F)(F)F.O=S(=O)(F)C(F)(F)F.O=S(=O)(F)C(F)(F)F.O=S(=O)(F)C(F)(F)F.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.39
CA1 P00915 3/20 0.39
CA5A P35218 3/20 0.39
CA9 Q16790 3/20 0.39
GPR3 P46089 2/20 0.38
FAAH O00519 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
ELANE P08246 1/20 0.37
PRTN3 P24158 1/20 0.37
PRSS3 P35030 1/20 0.37
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HTR6 P50406 1/20 0.33
APOBEC3G Q9HC16 1/20 0.32
CES1 P23141 1/20 0.32
PTPN1 P18031 3/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CA12 O43570 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
Trifluoromethanesulfonic Acid SCHEMBL31155703 0.84 GPR3 (0.50) CA2CA1CA5ACA9GPR3
Trifluoromethanesulfonic Acid SCHEMBL37032 0.84 GPR3 (0.50) CA2CA1CA5ACA9GPR3
Trifluoromethanesulfonic Acid SCHEMBL759937 0.84 PTPN1 (0.41) CA2CA1CA5ACA9GPR3
Trifluoromethanesulfonic Acid SCHEMBL10008137 0.83 GPR3 (0.48) CA2CA1CA5ACA9GPR3
Trifluoromethanesulfonic Acid SCHEMBL6118365 0.83 GPR3 (0.48) CA2CA1CA5ACA9GPR3
SCHEMBL5078707 0.81 FAAH (0.39) CA2CA1CA5ACA9GPR3
SCHEMBL2283421 0.81 FAAH (0.39) CA2CA1CA5ACA9GPR3
SCHEMBL7102917 0.81 FAAH (0.39) CA2CA1CA5ACA9GPR3
SCHEMBL561475 0.81 FAAH (0.39) CA2CA1CA5ACA9GPR3
SCHEMBL7914149 0.81 FAAH (0.39) CA2CA1CA5ACA9GPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9623605-B2 Thermally cross-linkable photo-hydrolyzable inkjet printable polymers for microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-04-18 US claimed
US-8491083-B2 Inkjet printing of microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-07-23 US claimed
US-20120105534-A1 INKJET PRINTING OF MICROFLUIDIC CHANNELS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-05-03 US claimed
US-10828883-B2 Thermally cross-linkable photo-hydrolyzable inkjet printable polymers for microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2020-11-10 US disclosed
US-20190210352-A1 THERMALLY CROSS-LINKABLE PHOTO-HYDROLYZABLE INKJET PRINTABLE POLYMERS FOR MICROFLUIDIC CHANNELS INTERNATIONAL BUSINESS MACHINES CORPORATION 2019-07-11 US disclosed
US-10272663-B2 Thermally cross-linkable photo-hydrolyzable inkjet printable polymers for microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2019-04-30 US disclosed
US-20170129174-A1 THERMALLY CROSS-LINKABLE PHOTO-HYDROLYZABLE INKJET PRINTABLE POLYMERS FOR MICROFLUIDIC CHANNELS INTERNATIONAL BUSINESS MACHINES CORPORATION 2017-05-11 US disclosed
US-9623605-B2 Thermally cross-linkable photo-hydrolyzable inkjet printable polymers for microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-04-18 US disclosed
US-20140072777-A1 THERMALLY CROSS-LINKABLE PHOTO-HYDROLYZABLE INKJET PRINTABLE POLYMERS FOR MICROFLUIDIC CHANNELS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-03-13 US disclosed
US-8491083-B2 Inkjet printing of microfluidic channels INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-07-23 US disclosed
US-20120105534-A1 INKJET PRINTING OF MICROFLUIDIC CHANNELS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-05-03 US disclosed