SCHEMBL192816

SCHEMBL192816

Nc1ccc(S(=O)(=O)O)cc1.[Zn]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.95
ALDH1A1 P00352 3/20 0.95
NT5E P21589 1/20 0.95
LMNA P02545 3/20 0.59
MPO P05164 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
HTR6 P50406 1/20 0.59
TDP1 Q9NUW8 4/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA12 O43570 2/20 0.56
CA9 Q16790 2/20 0.56
AGO2 Q9UKV8 2/20 0.56
CA14 Q9ULX7 2/20 0.56
USP2 O75604 1/20 0.56
CA4 P22748 1/20 0.56
CA6 P23280 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 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
SCHEMBL28160754 1.00 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL482994 0.97 TSHR (1.00) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL24407 0.97 TSHR (1.00) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL30495973 0.97 TSHR (1.00) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL31415204 0.97 TSHR (1.00) TSHRALDH1A1NT5ELMNAMPO
Sulfuric Acid SCHEMBL10596856 0.95 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL7766917 0.95 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO
Water SCHEMBL8586611 0.95 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL646074 0.95 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO
Hydrochloric Acid SCHEMBL4825957 0.95 TSHR (0.95) TSHRALDH1A1NT5ELMNAMPO

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 1067 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114015047-B S-containing polymer and preparation method thereof 四川大学 2022-09-23 CN claimed
US-20220169680-A1 CELL-PENETRATING PEPTIDE BASED ON INFLUENZA VIRUS M2 PROTEIN INSTITUTE OF BASIC MEDICAL SCIENCES CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2022-06-02 US claimed
CN-114015047-A S-containing polymer and preparation method thereof 四川大学 2022-02-08 CN claimed
EP-3912989-A1 CELL-PENETRATING PEPTIDE BASED ON INFLUENZA VIRUS M2 PROTEIN Institute of Basic Medical Sciences Chinese Academy of Medical Sciences (CN) 2021-11-24 EP claimed
CN-113582217-A Preparation method of ZnO/carbon composite interlayer 湖南师范大学 2021-11-02 CN claimed
CN-112851931-A Corrosion-resistant polyarylether resin, corrosion-resistant separation membrane and preparation method thereof 四川大学 2021-05-28 CN claimed
CN-111569680-B Polyarylether ultrafiltration membrane, nanofiltration membrane, preparation method and method for reversible conversion of ultrafiltration membrane and nanofiltration membrane 四川大学 2021-03-19 CN claimed
CN-111569680-A Polyarylether ultrafiltration membrane, nanofiltration membrane, preparation method and method for reversible conversion of ultrafiltration membrane and nanofiltration membrane 四川大学 2020-08-25 CN claimed
US-8268352-B2 Modified release composition for highly soluble drugs TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-18 US claimed
US-8263125-B2 Dosage form for high dose-high solubility active ingredients that provides for immediate release and modified release of the active ingredients TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-11 US claimed
US-20070093462-A1 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2007-04-26 US claimed
WO-2007044693-A2 MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS THE UNIVERSITY OF ALABAMA (US) 2007-04-19 WO claimed
CN-1826129-A Methods and compositions relating to isoleucine boroproline compounds POINT THERAPEUTICS INC (US) 2006-08-30 CN claimed
US-20060024365-A1 Novel dosage form VAYA NAVIN 2006-02-02 US claimed
US-20060018933-A1 Novel drug delivery system TORRENT PHARMACEUTICALS LIMITED (IN) 2006-01-26 US claimed
US-20060018934-A1 Novel drug delivery system TORRENT PHARMACEUTICALS LIMITED (IN) 2006-01-26 US claimed
EP-1578434-A2 METHODS AND COMPOSITIONS RELATING TO ISOLEUCINE BOROPROLINE COMPOUNDS Point Therapeutics, Inc. (US) 2005-09-28 EP claimed
US-20040131628-A1 Nucleic acids for the treatment of disorders associated with microorganisms BRATZLER ROBERT L (US) 2004-07-08 US claimed
US-20040077601-A1 Methods and compositions relating to isoleucine boroproline compounds POINT THERAPEUTICS, INC. 2004-04-22 US claimed
WO-2004004658-A2 METHODS AND COMPOSITIONS RELATING TO ISOLEUCINE BOROPROLINE COMPOUNDS POINT THERAPEUTICS, INC. (US) 2004-01-15 WO claimed

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

For each of this compound's patents that has machine-readable text (2 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-20070093462-A1 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients SLC5A6, PNLIP, IPMK TSHR 4253/4885ALDH1A1 2937/4885NT5E 1045/4885
US-20040077601-A1 Methods and compositions relating to isoleucine boroproline compounds BCAT1, BCAT2, APOB TSHR 1945/4885ALDH1A1 2720/4885NT5E 1553/4885

“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.