SCHEMBL648070

SCHEMBL648070

C=CC(=O)OC(C)(C)C.C=CC(=O)OCC(C)C

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.75
ALDH1A1 P00352 6/20 0.39
TP53 P04637 3/20 0.39
HIF1A Q16665 3/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.38
THRB P10828 2/20 0.37
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
PRKCA P17252 3/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL29612806 0.89 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17868882 0.88 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL16448 0.87
SCHEMBL28192845 0.87 TSHR (1.00) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL25298914 0.85 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylic Acid SCHEMBL28151617 0.85 TSHR (0.54) TSHRALDH1A1
Ethylene SCHEMBL304996 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Fluoride SCHEMBL27952802 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Hydrochloric Acid SCHEMBL27467016 0.85 TSHR (0.95) TSHRALDH1A1TP53HIF1ACYP3A4
Propene SCHEMBL29115915 0.83 TSHR (0.91) 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636318-B2 INTUMESCENT COATING COMPOSITIONS W & J LEIGH & CO (GB) 2011-05-18 EP claimed
US-20090143501-A1 INTUMESCENT COATING COMPOSITIONS W. & J. LEIGH & CO. (GB) 2009-06-04 US claimed
US-20090142495-A1 INTUMESCENT COATING COMPOSITIONS W. & J. LEIGH & CO. (GB) 2009-06-04 US claimed
US-20080224105-A1 Intumescent Coating Compositions SHERWIN-WILLIAMS PROTECTIVE & MARINE COATINGS (GB) 2008-09-18 US claimed
EP-1846513-A1 INTUMESCENT COATING COMPOSITIONS W. & J. Leigh & Co. (GB) 2007-10-24 EP claimed
EP-1636318-B1 INTUMESCENT COATING COMPOSITIONS W & J LEIGH & CO (GB) 2007-02-14 EP claimed
WO-2006067478-A1 INTUMESCENT COATING COMPOSITIONS W. & J. LEIGH & CO. (GB) 2006-06-29 WO claimed
EP-1636318-A1 INTUMESCENT COATING COMPOSITIONS W. & J. Leigh & Co. (GB) 2006-03-22 EP claimed
WO-2005000975-A1 INTUMESCENT COATING COMPOSITIONS W. & J. LEIGH & CO., (GB) 2005-01-06 WO claimed
US-20240417523-A1 COMPOSITION AND FILMS COMPRISING POLYLACTIC ACID POLYMER AND COPOLYMER COMPRISING LONG CHAIN ALKYL MOIETY 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-12-19 US disclosed
CN-101928357-B Dispersion stabilizer for suspension polymerization of vinyl compounds and preparation method thereof CHINA PETROCHEMICAL CORP 2015-02-11 CN disclosed
EP-2568012-B1 ELASTOMER COMPOSITION AND STOPPER FOR MEDICAL CONTAINER ARON KASEI KK (JP) 2015-01-14 EP disclosed
US-8658727-B2 Elastomer composition and stopper for medical container ARONKASEI CO., LTD (JP) 2014-02-25 US disclosed
US-20130231433-A1 ELASTOMER COMPOSITION AND STOPPER FOR MEDICAL CONTAINER ARONKASEI CO., LTD. (JP) 2013-09-05 US disclosed
EP-2568012-A1 ELASTOMER COMPOSITION AND STOPPER FOR MEDICAL CONTAINER Aronkasei Co., Ltd. (JP) 2013-03-13 EP disclosed
US-8119727-B2 Use of comb polymers as a grinding agent for preparations containing cement BASF AKTIENGESELLSCHAFT (DE) 2012-02-21 US disclosed
CN-101928357-A Dispersion stabilizer for suspension polymerization of vinyl compounds and preparation method thereof CHINA PETROCHEMICAL CORP 2010-12-29 CN disclosed
US-20080293850-A1 Use of Comb Polymers as a Grinding Agent for Preparations Containing Cement BASF SE (DE) 2008-11-27 US disclosed
US-7261991-B2 Image forming method and image forming apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-28 US disclosed
US-20060040199-A1 Image forming method and image forming apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2006-02-23 US disclosed