SCHEMBL4845895

SCHEMBL4845895

C=CC(=O)OCCC(=O)OCC(O)CBr

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.43
ALDH1A1 P00352 4/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 2/20 0.43
HSD17B10 Q99714 1/20 0.43
HPGD P15428 1/20 0.40
THRB P10828 2/20 0.34
KDM4E B2RXH2 1/20 0.34
DUSP3 P51452 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
DGKA P23743 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ENPP2 Q13822 2/20 0.31
TRPV1 Q8NER1 1/20 0.31
FAAH O00519 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
SCHEMBL12213002 0.85 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL6752095 0.85 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20340335 0.84 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4850233 0.84 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL301192 0.84 KDM4E (0.47) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4848928 0.84 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17970064 0.83 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9443523 0.81 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4843885 0.80 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3412116 0.79 TSHR (0.53) 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 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