SCHEMBL3374912

SCHEMBL3374912

O=S(=O)(OSc1ccccc1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.36
CA1 P00915 4/20 0.36
CA9 Q16790 2/20 0.36
CA5A P35218 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGLL Q99685 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
GPR3 P46089 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 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
SCHEMBL3684084 0.84 ALDH1A1 (0.33) CA2CA1MMP8MMP13ALDH1A1
SCHEMBL4249989 0.82 DNMT1 (0.40) CA2CA1CA9CA5AMAPT
SCHEMBL4263921 0.80 CA1 (0.40) CA2CA1CA9MAPTSMN1; SMN2
SCHEMBL3683894 0.80 PKM (0.41) CA2CA1CA9PTGS1PTGS2
SCHEMBL4575025 0.78 ALDH1A1 (0.37) CA2CA1CA9MAPTHPGD
SCHEMBL2786480 0.78 PTGS2 (0.35) CA2CA1PTGS1PTGS2CA12
SCHEMBL27304396 0.74 SMN1; SMN2 (0.41) CA2CA1CA9MAPTHPGD
SCHEMBL2878845 0.74 KEAP1 (0.37) CA2CA1CA9CA5APTGS1
SCHEMBL29048521 0.73 SMN1; SMN2 (0.55) CA2CA1CA9MAPTHPGD
SCHEMBL5023011 0.73 CA12 (0.33) CA2CA1MAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240369924-A1 RESIST COMPOSITION AND RESIST FILM FORMING METHOD USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-11-07 US disclosed
WO-2024168123-A1 SYNTHESIS OF CORE 2 O-SIALYL LEWIS-X POLYSACCHARIDES BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2024-08-15 WO disclosed
US-10098974-B2 Catalytic radiofluorination THE GENERAL HOSPITAL CORPORATION (US) 2018-10-16 US disclosed
US-20150132223-A1 Catalytic Radiofluorination THE GENERAL HOSPITAL CORPORATION 2015-05-14 US disclosed
US-8900550-B2 Catalytic radiofluorination THE GENERAL HOSPITAL CORPORATION (US) 2014-12-02 US disclosed
US-8524873-B2 Sugar donor RIKEN (JP) 2013-09-03 US disclosed
US-20130115168-A1 Catalytic Radiofluorination THE GENERAL HOSPITAL CORPORATION (US) 2013-05-09 US disclosed
US-8257680-B1 Catalytic radiofluorination THE GENERAL HOSPITAL CORPORATION (US) 2012-09-04 US disclosed
US-20120207677-A1 CATALYTIC RADIOFLUORINATION THE GENERAL HOSPITAL CORPORATION 2012-08-16 US disclosed
EP-1829884-B1 Sugar donor RIKEN (JP) 2010-11-10 EP disclosed
WO-2008022319-A2 CATALYTIC RADIOFLUORINATION THE GENERAL HOSPITAL CORPORATION (US) 2008-02-21 WO disclosed
US-20070208171-A1 SUGAR DONOR RIKEN (JP) 2007-09-06 US disclosed
EP-1829884-A1 Sugar donor Riken (JP) 2007-09-05 EP disclosed
US-6388059-B1 CONTACTING GLYCOSIDE HAVING ANOMERIC SULFOSIDE WITH COMPOUND HAVING FREE HYDROXYL IN PRESENCE OF ORGANIC ACID ANHYDRIDE AND ALKENE TO SCAVENGE SULFENYL ESTERS; INCREASED YIELD WITH REDUCED BY-PRODUCT FORMATION THE TRUSTEES OF PRINCETON UNIVERSITY 2002-05-14 US disclosed
EP-1097163-A4 IMPROVED GLYCOSYLATION METHOD USING SULFOXIDE DONORS UNIV PRINCETON (US) 2002-03-06 EP disclosed
EP-1097163-A1 IMPROVED GLYCOSYLATION METHOD USING SULFOXIDE DONORS Princeton University (US) 2001-05-09 EP disclosed
WO-2000004035-A1 IMPROVED GLYCOSYLATION METHOD USING SULFOXIDE DONORS PRINCETON UNIVERSITY (US) 2000-01-27 WO disclosed
US-5635612-A Method of forming multiple glycosidic linkages in a single step THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-06-03 US disclosed
EP-0377175-A2 Pattern forming composition and process for forming pattern using the same HITACHI, LTD. (JP) 1990-07-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130115168-A1 Catalytic Radiofluorination ARSA, STS, KCNK18 CA2 80/4885CA1 132/4885CA9 138/4885
US-20070208171-A1 SUGAR DONOR GCK, G6PD, SLC2A4 CA2 4287/4885CA1 4046/4885CA9 3255/4885
US-10098974-B2 Catalytic radiofluorination ARSA, STS, KCNK18 CA2 80/4885CA1 132/4885CA9 138/4885
US-20150132223-A1 Catalytic Radiofluorination ARSA, KCNK18, STS CA2 148/4885CA1 155/4885CA9 192/4885
US-20120207677-A1 CATALYTIC RADIOFLUORINATION ARSA, STS, KCNK18 CA2 80/4885CA1 132/4885CA9 138/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.