SCHEMBL7055868

SCHEMBL7055868

C=CC(=O)OC(CN)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
ALDH1A1 P00352 4/20 0.34
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL6782736 0.82 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL18297186 0.80 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL18561861 0.80 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23494171 0.78 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL24384252 0.77 TSHR (0.37) TSHRALDH1A1TP53HIF1ACYP3A4
Dimethylamine SCHEMBL1568532 0.77 TSHR (0.37) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL445644 0.77 LMNA (0.38) TSHRCYP3A4HSD17B10
SCHEMBL6524585 0.75 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL202442 0.75
SCHEMBL4953193 0.74 TSHR (0.46) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189755-B1 INKJET PRINTING MEDIA CONTAINING SUBSTANTIALLY WATER-INSOLUBLE PLASTICIZER HEWLETT PACKARD CO (US) 2003-04-23 EP disclosed
EP-0988154-B1 COATING COMPOSITION AND PRINTING MEDIUM HEWLETT PACKARD CO (US) 2002-11-06 EP disclosed
EP-0988152-B1 COATING COMPOSITION AND PRINTING MEDIUM HEWLETT PACKARD CO (US) 2002-10-30 EP disclosed
US-6340725-B1 COATING COMPOSITION, BINDERS, CATIONIC ADDITION POLYMER AND WATER INSOLUBLE FILLER PARTICLES HEWLETT-PACKARD COMPANY 2002-01-22 US disclosed
US-6265049-B1 BINDER BLEND CONTAINING POLYOXYETHYLENE GLYCOL AND CATIONIC POLYMER HEWLETT-PACKARD COMPANY 2001-07-24 US disclosed
US-6183844-B1 MULTILAYER COATINGS FOR PRINTING WITH SUBSTRATES AND ABSORBANT COATINGS AND PARTICLES HEWLETT-PACKARD COMPANY 2001-02-06 US disclosed
US-6074761-A COATING COMPRISES A BINDER CONSISTS OF ORGANIC POLYMER FREE OR AMMONIUM GROUPS, A CATIONIC ADDITION POLYMER CONTAINING QUATERNARY AMMONIUM GROUP, A SECOND ADDITION CATION POLYMER CONTAINING SECONDARY OR TERTIARY AMINE GROUPS, AND A FILLER PPG INDUSTRIES OHIO, INC. (US) 2000-06-13 US disclosed
US-5880196-A VOLATILE AQUEOUS LIQUID MEDIUM CONTAINING ONIUM-FREE AND ONIUM-CONTAINING POLYMERIC BINDERS, FINELY DIVIDED PSEUDOBOEHMITE PARTICLES; NONBLEEDING PPG INDUSTRIES, INC. (US) 1999-03-09 US disclosed