SCHEMBL7208965

SCHEMBL7208965

C=CC(=O)OCCOC=CC

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.57
ALDH1A1 P00352 4/20 0.57
TP53 P04637 3/20 0.57
HIF1A Q16665 3/20 0.57
HSD17B10 Q99714 1/20 0.57
CYP3A4 P08684 2/20 0.52
HPGD P15428 1/20 0.52
THRB P10828 4/20 0.47
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.32
HCAR2 Q8TDS4 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
SCHEMBL9636198 1.00 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3315558 0.94 TSHR (0.68) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7212693 0.89 TSHR (0.59) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5973231 0.83 ATM (0.48) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL991606 0.83 ATM (0.48) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5973818 0.83 ATM (0.48) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5973821 0.83 ATM (0.48) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL991608 0.83 ATM (0.48) TSHRALDH1A1TP53HIF1AHSD17B10
Propene SCHEMBL11227474 0.83 TSHR (0.73) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL30604742 0.80 TSHR (0.84) 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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140242722-A1 ARTICLE AND METHOD FOR DETECTION OF A DRUG IN A LIQUID MEDIUM MEDTECH DETECT, LLC (US) 2014-08-28 US claimed
WO-2014062910-A1 SPIROPYRAN-BASED COLORIMETRIC DETECTION MEDTECH DETECT, LLC (US) 2014-04-24 WO claimed
US-4801669-A Process for the quasi-ionic polymerization of acrylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1989-01-31 US claimed
WO-2015066459-A1 ANALYTE DETECTION DEVICE AND METHODS OF USING SAME MEDTECH BIOSCIENCE, LLC (US) 2015-05-07 WO disclosed
US-20140242722-A1 ARTICLE AND METHOD FOR DETECTION OF A DRUG IN A LIQUID MEDIUM MEDTECH DETECT, LLC (US) 2014-08-28 US disclosed
WO-2014062910-A1 SPIROPYRAN-BASED COLORIMETRIC DETECTION MEDTECH DETECT, LLC (US) 2014-04-24 WO disclosed
US-6613855-B1 Thin insulating films excellent in heat resistance, solvent resistance, low water absorption, insulating property, low dielectric constant, SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-02 US disclosed
US-20020016269-A1 Particle perfume delivery system THE PROCTER & GAMBLE CO. 2002-02-07 US disclosed
WO-2002004586-A1 A PARTICLE PERFUME DELIVERY SYSTEM THE PROCTER & GAMBLE COMPANY (US) 2002-01-17 WO disclosed
WO-2000068275-A1 NON-SYMMETRICAL FREE RADICAL INITIATORS AND PROCESS FOR USE THEREWITH THE PROCTER & GAMBLE COMPANY (US) 2000-11-16 WO disclosed
EP-0662485-B1 Method of controlling the polymerization of acrylates DOW CORNING (US) 1998-03-25 EP disclosed
US-5359018-A Group transfer polymerization using initiator and zinc, cadmium, or mercury halides and iodine as catalysts DOW CORNING CORPORATION (US) 1994-10-25 US disclosed
EP-0291212-B1 POLYMERIZATION OF ACRYLIC ESTERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-24 EP disclosed
EP-0463774-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-01-02 EP disclosed
EP-0413464-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-02-20 EP disclosed
EP-0413465-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-02-20 EP disclosed
US-4801669-A Process for the quasi-ionic polymerization of acrylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1989-01-31 US disclosed
EP-0291212-A1 Polymerization of acrylic esters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-11-17 EP disclosed
US-4771117-A COCATALYST SYSTEM WITH A TETRACOORDIATE SILICONE ORGANIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-13 US disclosed
US-4626579-A USING MERCAPTOSILANE INITIATOR IN PRESENCE OF NUCLEOPHILIC OR ELECTROPHILIC CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1986-12-02 US disclosed