SCHEMBL4843885

SCHEMBL4843885

C=CC(=O)OCCOCC(O)CBr

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.60
ALDH1A1 P00352 4/20 0.60
TP53 P04637 3/20 0.60
HIF1A Q16665 3/20 0.60
HSD17B10 Q99714 1/20 0.60
THRB P10828 2/20 0.46
CYP3A4 P08684 2/20 0.46
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 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
SCHEMBL4850468 0.90 TSHR (0.56) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4846466 0.90 TSHR (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7267530 0.84 TSHR (0.62) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4850233 0.83 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL20340335 0.83 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL8518852 0.83 TSHR (0.60) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4850587 0.83 TSHR (0.60) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL12629198 0.82 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL9418348 0.82 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL13230684 0.80 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459185-B2 Treatment of natural polymer based materials and the products based thereon COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 2008-12-02 US disclosed
US-20050048207-A1 Treatment of natural polymer based materials and the products based thereon COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2005-03-03 US disclosed
US-6830784-B2 Treating natural polymeric material with a modifying agent selected from coupling agents and multi-functional amine compounds; subjecting to solvent extraction and/or treatment with physical field and/or oxidation COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-12-14 US disclosed
US-6800331-B2 REACTING THE FUNCTIONALIZED SURFACE WITH A COMPOUND CONTAININGAT LEAST FOUR AMINE GROUPS AND A CROSSLINKING AGENT REACTIVE WITH THE POLYAMINE; TO PROVIDE A CROSSLINKED NETWORK GRAFTED TO THE SUBSTRATE SURFACE. COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-10-05 US disclosed
EP-1242516-B1 PREPARATION OF FUNCTIONAL POLYMERIC SURFACE COMMW SCIENT IND RES ORG (AU) 2004-08-25 EP disclosed
EP-1253999-A4 TREATMENT OF NATURAL POLYMER BASED MATERIALS AND THE PRODUCTS BASED THEREON COMMW SCIENT IND RES ORG (AU) 2004-08-11 EP disclosed
US-20040115354-A1 Apparatus for surface engineering COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-06-17 US disclosed
US-6706320-B2 USING SOLUTION OF ADJUVANT AND SOLVENT; VAPORIZATION TO REMOVAL SOLVENT COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-03-16 US disclosed
US-20030194504-A1 Preparation of functional polymeric surface COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-10-16 US disclosed
US-20030157268-A1 Treatment of natural polymer based materials and the products based thereon COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-08-21 US disclosed
WO-2003066512-A1 SYNTHETIC CLOSURE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-08-14 WO disclosed
EP-1253999-A1 TREATMENT OF NATURAL POLYMER BASED MATERIALS AND THE PRODUCTS BASED THEREON COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2002-11-06 EP disclosed
EP-1242516-A1 PREPARATION OF FUNCTIONAL POLYMERIC SURFACE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2002-09-25 EP disclosed
US-20020018860-A1 Method and apparatus for surface engineering COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2002-02-14 US disclosed
WO-2002004552-A1 A PROCESS FOR MODIFYING THE SURFACE OF A SUBSTRATE CONTAINING A POLYMERIC MATERIAL BY MEANS OF VAPORISING THE SURFACE MODIFYING AGENT COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2002-01-17 WO disclosed
WO-2001056756-A1 TREATMENT OF NATURAL POLYMER BASED MATERIALS AND THE PRODUCTS BASED THEREON COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2001-08-09 WO disclosed
WO-2001029118-A1 PREPARATION OF FUNCTIONAL POLYMERIC SURFACE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2001-04-26 WO disclosed