SCHEMBL4647014

SCHEMBL4647014

O=C(CCC(=O)OS)OS.[GaH3]

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
KDM6B O15054 1/20 0.31
KDM5C P41229 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 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
SCHEMBL504194 0.96 TSHR (0.44) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL27798854 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL7901796 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL2801984 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL2771038 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL23174294 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL29028814 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL10486807 0.93 TSHR (0.42) TSHRADRA2AADRA1AALDH1A1HSD17B10
SCHEMBL330109 0.90 TSHR (0.40) TSHRADRA2AADRA1AALDH1A1HSD17B10
Ethylene Glycol SCHEMBL27279388 0.87 TSHR (0.38) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1777712-B1 Method for Recycling Thallium-203 Isotope in Remnant Solution of Thallium-201 Radioisotope ATOMIC ENERGY COUNCIL (TW) 2008-08-20 EP disclosed
US-20070098607-A1 Method for recycling thallium - 203 isotope in remnant solution of thallium - 201 radioisotope ATOMIC ENERGY COUNCIL - INSTITUTE OF NUCLEAR ENERGY RESEARCH 2007-05-03 US disclosed
EP-1777712-A1 Method for Recycling Thallium-203 Isotope in Remnant Solution of Thallium-201 Radioisotope Atomic Energy Council - Institute of Nuclear Energy Research (TW) 2007-04-25 EP disclosed
US-5639439-A Gallium dimercaptosuccinate as a novel tumor imaging agent INSTITUTE OF NUCLEAR ENERGY RESEARCH, TAIWAN (TW) 1997-06-17 US disclosed
US-5639439-A Gallium dimercaptosuccinate as a novel tumor imaging agent INSTITUTE OF NUCLEAR ENERGY RESEARCH, TAIWAN (TW) 1997-06-17 US disclosed
US-5639439-A Gallium dimercaptosuccinate as a novel tumor imaging agent INSTITUTE OF NUCLEAR ENERGY RESEARCH, TAIWAN (TW) 1997-06-17 US disclosed