SCHEMBL1376263

SCHEMBL1376263

CCCCCOc1ccc(S(N)(=O)=O)cc1

nearest known ligand 0.93

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.93
CA1 P00915 13/20 0.93
CA9 Q16790 13/20 0.93
CA12 O43570 12/20 0.93
CA7 P43166 5/20 0.93
TSHR P16473 1/20 0.93
CA4 P22748 5/20 0.64
HRH3 Q9Y5N1 4/20 0.59
KCNH2 Q12809 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL1333401 0.98 CA2 (0.90) CA2CA1CA9CA12CA7
SCHEMBL8618402 0.98 CA2 (0.90) CA2CA1CA9CA12CA7
SCHEMBL9848224 0.98 CA2 (0.90) CA2CA1CA9CA12CA7
SCHEMBL10822914 0.98 CA2 (0.90) CA2CA1CA9CA12CA7
SCHEMBL6550862 0.98 CA2 (0.90) CA2CA1CA9CA12CA7
SCHEMBL615392 0.96 CA2 (1.00) CA2CA1CA9CA12CA7
SCHEMBL5595956 0.89 CA1 (1.00) CA2CA1CA9CA12CA7
SCHEMBL19891669 0.89 CA12 (0.79) CA2CA1CA9CA12CA7
SCHEMBL28005088 0.88 CA1 (0.72) CA2CA1CA9CA12CA7
SCHEMBL28817746 0.87 CA1 (0.70) CA2CA1CA9CA12CA7

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021041667-A1 MODIFYING MESSAGES STORED IN MIXTURES OF MOLECULES USING THIN-LAYER CHROMATOGRAPHY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-03-04 WO disclosed
EP-2395334-B1 THERMAL DISTRIBUTION DISPLAY AND METHOD FOR CONFIRMING THERMAL DISTRIBUTION FUJIFILM CORP (JP) 2016-12-28 EP disclosed
US-20120252741-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS BIOMARIN PHARMACEUTICAL INC. (US) 2012-10-04 US disclosed
US-20110287548-A1 THERMAL DISTRIBUTION DISPLAY AND METHOD FOR CONFIRMING THERMAL DISTRIBUTION FUJIFILM CORPORATION (JP) 2011-11-24 US disclosed
US-20100105607-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS LEAD THERAPEUTICS, INC. (US) 2010-04-29 US disclosed
WO-2010048340-A2 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS LEAD THERAPEUTICS, INC. (US) 2010-04-29 WO disclosed
US-7576036-B2 Heat-sensitive recording material, heat-sensitive recording method and method for manufacturing heat-sensitive recording material FUJIFILM CORPORATION (JP) 2009-08-18 US disclosed
US-7399569-B2 Method for producing microcapsules, microcapsules, recording material, and heat-sensitive recording material FUJIFILM CORPORATION (JP) 2008-07-15 US disclosed
US-7270928-B2 Isocyanate composition, microcapsule and production method thereof, and recording material FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-20070032381-A1 Heat-sensitive recording material, heat-sensitive recording method and method for manufacturing heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2007-02-08 US disclosed
US-20030118851-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2003-06-26 US disclosed
US-20030114305-A1 Multicolor heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2003-06-19 US disclosed
US-20030114302-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-06-19 US disclosed
US-20030045426-A1 Heat sensitive recording material and microcapsule solution FUJI PHOTO FILM CO., LTD. 2003-03-06 US disclosed
US-20030013608-A1 Thermal recording material FUJI PHOTO FILM CO., LTD. 2003-01-16 US disclosed
US-20020187417-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2002-12-12 US disclosed
US-20020172805-A1 Thermal recording material FUJI PHOTO FILM CO., LTD. 2002-11-21 US disclosed
US-20020042414-A1 Diamide compound and medicine containing the same KOWA CO., LTD. (JP) 2002-04-11 US disclosed
US-6340682-B1 FOR THERAPY OF ALLERGIC IMMUNOLOGICAL DISEASE IS SELECTED FROM ASTHMA, ALLERGIC RHINITIS, INFLAMMATORY LARGE BOWEL DISEASE OR CONTACT DERMATITIS KOWA CO., LTD. (JP) 2002-01-22 US disclosed
US-5916680-A CONTAINING A DIAZO COMPOUND OR AN ELECTRON DONATIVE DYE PRECURSOR, WHEREIN THE CAPSULE WALL IS COMPOSED OF AT LEAST ONE POLYMER OBTAINED BY POLYMERIZATION OF AN ISOCYANATE COMPOUND CONTAINING AN ADDUCT FUJI PHOTO FILM CO., LTD (JP) 1999-06-29 US 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 (3 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-20100105607-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS ASNS, ALG8, ALG1 CA2 3594/4885CA1 2552/4885CA9 2299/4885
US-20020042414-A1 Diamide compound and medicine containing the same HRH4, HRH2, HRH1 CA2 40/4885CA1 639/4885CA9 531/4885
US-20120252741-A1 NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS ASNS, DNPEP, ALG8 CA2 2937/4885CA1 2394/4885CA9 2074/4885

“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.