SCHEMBL4639600

SCHEMBL4639600

C=C(C)C(=O)OCCOS(=O)(=O)O.[NaH]

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.53
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FNTA P49354 2/20 0.34
FNTB P49356 2/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL154342 0.98 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
Ammonia Solution, Strong SCHEMBL720362 0.96 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL30876969 0.96 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
Trimethylammonium SCHEMBL6026219 0.93 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8362110 0.93 THRB (0.59) THRBTSHRALDH1A1POLBAPEX1
Dimethylamine SCHEMBL5034396 0.93 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
Trimethylammonium SCHEMBL27532167 0.91 THRB (0.49) THRBTSHRALDH1A1POLBAPEX1
Ammonia Solution, Strong SCHEMBL8943081 0.91 THRB (0.58) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL5969177 0.87 TSHR (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL5969201 0.87 TSHR (0.59) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230137331-A1 Activation and Expansion of T Cell Subsets Using Biocompatible Solid Substrates with Tunable Rigidity UNIV PENNSYLVANIA (US) 2023-05-04 US claimed
US-20150030619-A1 Activation and Expansion of T Cell Subsets Using Biocompatible Solid Substrates with Tunable Rigidity THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-01-29 US claimed
WO-2013036585-A1 ACTIVATION AND EXPANSION OF T CELL SUBSETS USING BIOCOMPATIBLE SOLID SUBSTRATES WITH TUNABLE RIGIDITY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-03-14 WO claimed
EP-0580726-B2 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY IMARX PHARMACEUTICAL CORP (US) 2008-08-20 EP claimed
US-6998107-B2 Composition comprising low density microspheres BRISTOL-MYERS SQUIBB PHARMA COMAPANY (US) 2006-02-14 US claimed
US-20040223914-A1 Composition comprising low density microspheres BRISTOL-MYERS SQUIBB MEDICAL IMAGING INC. 2004-11-11 US claimed
US-6773696-B2 WHEREIN VOID COMPRISES VAPOR OF VOLATILE LIQUID (ALIPHATIC HYDROCARBONS, CHLOROFLUOROCARBONS, TETRAALKYL SILANES, AND PERFLUOROCARBONS); FOR COMPUTED TOMOGRAPHY IMAGING OF THE GASTROINTESTINAL REGION BRISTOL-MYERS SQUIBB MEDICAL IMAGING, INC. 2004-08-10 US claimed
US-20030053953-A1 Contrast agent comprising low density microspheres LANTHEUS MI REAL ESTATE, LLC 2003-03-20 US claimed
US-6528039-B2 Administering to a patient a contrast medium comprising a homogenous aqueous suspension of low density polymeric microsphere filled with a gas, scanning the patient using computed tomography imaging to obtain visible image of tissue BRISTOL-MYERS SQUIBB MEDICAL IMAGING, INC. 2003-03-04 US claimed
US-20010024639-A1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY AND IN OTHER APPLICATIONS LANTHEUS HOLDINGS, INC. 2001-09-27 US claimed
EP-0580726-B1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY IMARX PHARMACEUTICAL CORP (US) 1999-06-02 EP claimed
EP-0804932-A2 Contrast media for diagnostic imaging comprising gas filled microspeures ImaRx Pharmaceutical Corp. (US) 1997-11-05 EP claimed
US-5547656-A Low density microspheres and their use as contrast agents for computed tomography, and in other applications IMARX PHARMACEUTICAL CORP. (US) 1996-08-20 US claimed
US-5527521-A AQUEOUS SUSPENSION OF BIOCOMPATIBLE POLYMER, A PERFLUOROCARBON GAS, AND A THICKENING OR SUSPENDING AGENT IMARX PHARMACEUTICAL CORP. (US) 1996-06-18 US claimed
US-5456900-A Low density microspheres and their use as contrast agents for computed tomography CITIZENS BANK, N.A. 1995-10-10 US claimed
EP-0580726-A4 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY. UNGER EVAN C (US) 1995-03-29 EP claimed
EP-0580726-A1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY IMARX PHARMACEUTICAL CORP. (US) 1994-02-02 EP claimed
US-5281408-A Low density microspheres and their use as contrast agents for computed tomography CITIZENS BANK, N.A. 1994-01-25 US claimed
US-5205290-A LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY CITIZENS BANK, N.A. 1993-04-27 US claimed
WO-1992017514-A1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY UNGER EVAN C (US) 1992-10-15 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 (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-20040223914-A1 Composition comprising low density microspheres MSR1, CD68, SGMS1 THRB 2173/4885TSHR 1262/4885ALDH1A1 2865/4885
US-20010024639-A1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY AND IN OTHER APPLICATIONS FABP2, FABP6, MLNR THRB 2387/4885TSHR 716/4885ALDH1A1 4309/4885
US-20030053953-A1 Contrast agent comprising low density microspheres MSR1, CD68, MTDH THRB 2050/4885TSHR 561/4885ALDH1A1 3109/4885

“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.