SCHEMBL7711981

SCHEMBL7711981

C=CC(=O)NCC(C(C)=O)S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
TGM2 P21980 5/20 0.34
GAA P10253 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
SCHEMBL14181402 0.79 KDM4E (0.39) TSHRALDH1A1MAPK1
SCHEMBL687556 0.78 TSHR (0.45) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL17171617 0.77 TSHR (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL28384050 0.77 TSHR (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL28479385 0.76 TSHR (0.43) TSHRALDH1A1MAPK1TDP1ZDHHC20
Sulfuric Acid SCHEMBL182294 0.76 CYP2D6 (0.50) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL9399860 0.76 TSHR (0.46) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL11694184 0.75 TSHR (0.42) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL28300 0.75 ZDHHC20 (0.44) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL295884 0.75 TSHR (0.50) TSHRALDH1A1MAPK1TDP1ZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0731664-B1 SENSOR WITH IMPROVED DRIFT STABILITY TERUMO CARDIOVASCULAR SYS (US) 2002-02-27 EP claimed
US-5403746-A Aqueous first phase comprising pH sensitive indicator in buffer solution dispersed in hydrophobic second phase permeable to analyte and impermeable to ionized hydrogen MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-04-04 US claimed
EP-0731664-B1 SENSOR WITH IMPROVED DRIFT STABILITY TERUMO CARDIOVASCULAR SYS (US) 2002-02-27 EP disclosed
US-5882936-A MEASURING CARBON DIOXIDE AND AMMONIA BLOOD GASES; PURIFICATION; FORMING SENSOR COMPRISING MICROCOMPARTMENTS OF AQUEOUS BUFFER DISPERSED IN CROSSLINKED POLYMER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-03-16 US disclosed
US-5607645-A Sensor with improved drift stability MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-03-04 US disclosed
EP-0731664-A1 SENSOR WITH IMPROVED DRIFT STABILITY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-09-18 EP disclosed
WO-1995015114-A1 SENSOR WITH IMPROVED DRIFT STABILITY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-06-08 WO disclosed
US-5403746-A Aqueous first phase comprising pH sensitive indicator in buffer solution dispersed in hydrophobic second phase permeable to analyte and impermeable to ionized hydrogen MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-04-04 US disclosed