SCHEMBL992168

SCHEMBL992168

CCOCCCS(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.42
ALDH1A1 P00352 3/20 0.40
TSHR P16473 4/20 0.38
HTT P42858 2/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.35
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
SLC6A6 P31641 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX2 P34913 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL716073 0.98 APP (0.41) APPALDH1A1TSHRHTTLMNA
SCHEMBL9452241 0.96 TSHR (0.40) APPALDH1A1TSHRHTTLMNA
SCHEMBL21184487 0.96 TSHR (0.40) APPALDH1A1TSHRHTTLMNA
SCHEMBL6599060 0.93 APP (0.41) APPALDH1A1TSHRHTTLMNA
SCHEMBL8740085 0.91 APP (0.39) APPALDH1A1TSHRHTTLMNA
SCHEMBL14114301 0.89 ALDH1A1 (0.39) APPALDH1A1TSHRHTTLMNA
SCHEMBL13804841 0.89 ALDH1A1 (0.39) APPALDH1A1TSHRHTTLMNA
SCHEMBL933723 0.85
SCHEMBL421993 0.85 APP (0.50) APPALDH1A1TSHRHTTLMNA
SCHEMBL22800834 0.84 TSHR (0.40) ALDH1A1TSHRHTTLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9562834-B2 Aqueous compositions and methods of using the same for histopathological evaluation of tissue samples NELSON JOHN J (US) 2017-02-07 US disclosed
WO-2016029103-A1 AQUEOUS COMPOSITIONS AND METHODS OF USING THE SAME FOR HISTOPATHOLOGICAL EVALUATION OF TISSUE SAMPLES NELSON JOHN J (US) 2016-02-25 WO disclosed
US-20160054206-A1 AQUEOUS COMPOSITIONS AND METHODS OF USING THE SAME FOR HISTOPATHOLOGICAL EVALUATION OF TISSUE SAMPLES NELSON JOHN J (US) 2016-02-25 US disclosed
EP-2883867-A2 Non-aqueous electrolytic solution, electrochemical element using the same and alkynyl compound used therefor Ube Industries, Ltd. (JP) 2015-06-17 EP disclosed
US-8900477-B2 Materials for polishing liquid for metal, polishing liquid for metal, method for preparation thereof and polishing method using the same HITACHI, LTD. (JP) 2014-12-02 US disclosed
US-20140339096-A1 METHOD FOR PRODUCING PERFLUOROSULFONIC ACID HAVING ETHER STRUCTURE AND DERIVATIVE THEREOF, AND SURFACTANT CONTAINING FLUORINE-CONTAINING ETHER SULFONIC ACID COMPOUND AND DERIVATIVE THEREOF MITSUBISHI MATERIALS CORP (JP) 2014-11-20 US disclosed
US-20140339096-A1 METHOD FOR PRODUCING PERFLUOROSULFONIC ACID HAVING ETHER STRUCTURE AND DERIVATIVE THEREOF, AND SURFACTANT CONTAINING FLUORINE-CONTAINING ETHER SULFONIC ACID COMPOUND AND DERIVATIVE THEREOF MITSUBISHI MATERIALS CORP (JP) 2014-11-20 US disclosed
US-8779119-B2 Metal salt of crosslinked cellulose derivative JNC CORPORATION (JP) 2014-07-15 US disclosed
US-8633223-B2 Process for preparation of 2-methyl-2′-phenylpropionic acid derivatives and novel intermediate compounds YUHAN CORPORATION (KR) 2014-01-21 US disclosed
US-8487106-B2 Process for preparation of 2-methyl-2′-phenylpropionic acid derivatives and novel intermediate compounds YUHAN CORPORATION (KR) 2013-07-16 US disclosed
US-20060216939-A1 a mixture of oxidizers, oxidized-metal etchants, protective film-forming agents and diluents, used for polishing semiconductors RENESAS ELECTRONICS CORPORATION (JP) 2006-09-28 US disclosed
EP-1150341-A1 MATERIALS FOR POLISHING LIQUID FOR METAL, POLISHING LIQUID FOR METAL, METHOD FOR PREPARATION THEREOF AND POLISHING METHOD USING THE SAME HITACHI CHEMICAL COMPANY, LTD. (JP) 2001-10-31 EP disclosed
US-5565297-A NONPOLAR LIQUID SOLUBLE CHARGE DIRECTOR CATIONIC COPOLYMER XEROX CORPORATION (US) 1996-10-15 US disclosed
US-5017619-A Anitdiabetic HOFFMANN-LA ROCHE INC. (US) 1991-05-21 US disclosed
EP-0155710-A2 Process for the preparation of derivatives of polyethoxypropanesulfonates MOBIL OIL CORPORATION (US) 1985-09-25 EP disclosed
US-4438002-A ENHANCED OIL RECOVERY USING WATER, PETROLEUM SULFONATES, ETHOXYLATED SULFATE OR SULFONATE SOLUBILIZERS, AND DICYCLOPENTADIENE SULFONATE TEXACO INC. (US) 1984-03-20 US disclosed
US-4436672-A ANIONIC SURFACTANTS TEXACO, INC. (US) 1984-03-13 US disclosed
US-4268623-A Photographic light-sensitive material having a carboxylic acid polymer antistatic layer FUJI PHOTO FILM CO., LTD. (JP) 1981-05-19 US disclosed
US-4190448-A ACRYLIC ACID POLYMER CROSSLINKED WITH POLYHYDRIC ALCOHOL IN PRESENCE OF CONDENSATION-TYPE CROSSLINKING AGENT FUJI PHOTO FILM CO., LTD. (JP) 1980-02-26 US disclosed
US-4111926-A O-IMIDOSULFONATES FUJI PHOTO FILM CO., LTD. (JP) 1978-09-05 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 (1 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-20140339096-A1 METHOD FOR PRODUCING PERFLUOROSULFONIC ACID HAVING ETHER STRUCTURE AND DERIVATIVE THEREOF, AND SURFACTANT CONTAINING FLUORINE-CONTAINING ETHER SULFONIC ACID COMPOUND AND DERIVATIVE THEREOF FRG1, RXRG, RER1 APP 4726/4885ALDH1A1 1543/4885TSHR 231/4885

“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.