SCHEMBL16295877

SCHEMBL16295877

C=CC(=O)OCCNC(O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.52
ALDH1A1 P00352 4/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.47
THRB P10828 2/20 0.40
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL16295835 0.87 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL26495275 0.86 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL344525 0.82 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL24221425 0.81
SCHEMBL25294131 0.81 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27809444 0.79 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL12860057 0.79 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3282484 0.78 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
Hydrochloric Acid SCHEMBL3517684 0.78 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL24262394 0.78 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3030592-A1 HYDROPHILIC COATINGS FORMED BY ATMOSPHERIC CO2 REACTION Empire Technology Development LLC (US) 2016-06-15 EP disclosed
WO-2014200484-A1 HYDROPHILIC COATINGS FORMED BY ATMOSPHERIC CO2 REACTION EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-12-18 WO disclosed
CN-101636525-A Method for the anti-corrosive treatment of metal substrates BASF COATINGS AG 2010-01-27 CN disclosed
CN-101312910-A Zinc oxide nanoparticles MERCK PATENT GMBH (DE) 2008-11-26 CN disclosed