Pivalate

Pivalate

SCHEMBL4916733

CC(C)(C)C(=O)[O-].CC[N+](C)(CC)CC

nearest known ligand 0.46

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 6/20 0.46
FFAR3 O14843 2/20 0.32
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC8 Q9BY41 2/20 0.32
SLC22A16 Q86VW1 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
SCHEMBL5182673 0.87 BBOX1 (0.45) BBOX1FFAR3HDAC3HDAC1HDAC2
Pivalate SCHEMBL4918272 0.86 BBOX1 (0.43) BBOX1FFAR3HDAC3HDAC1HDAC2
Bicarbonate SCHEMBL557717 0.83 BBOX1 (0.54) BBOX1FFAR3HDAC3HDAC1HDAC2
SCHEMBL28715637 0.81 BBOX1 (0.41) BBOX1
Tetrylammonium SCHEMBL2351319 0.81 TSHR (0.44) BBOX1FFAR3HDAC3HDAC1HDAC2
Pivalate SCHEMBL4916740 0.81 TSHR (0.38) BBOX1FFAR3
Bicarbonate SCHEMBL557719 0.80 BBOX1 (0.52) BBOX1FFAR3HDAC3HDAC1HDAC2
Bicarbonate SCHEMBL8995782 0.80 BBOX1 (0.52) BBOX1FFAR3HDAC3HDAC1HDAC2
Acetic Acid SCHEMBL557337 0.80 BBOX1 (0.52) BBOX1FFAR3HDAC3HDAC1HDAC2
Oxalic Acid SCHEMBL1052162 0.80 BBOX1 (0.52) BBOX1FFAR3HDAC3HDAC1HDAC2

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
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US claimed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP claimed
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US disclosed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP disclosed
US-20070135565-A1 COMPOSITION FOR FORMING POROUS FILM, POROUS FILM AND METHOD FOR FORMING THE SAME, INTERLEVEL INSULATOR FILM, AND SEMICONDUCTOR DEVICE MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2007-06-14 US disclosed
US-7132473-B2 Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2006-11-07 US disclosed
EP-1568744-A1 COMPOSITION FOR POROUS FILM FORMATION, POROUS FILM, PROCESS FOR PRODUCING THE SAME, INTERLAYER INSULATION FILM AND SEMICONDUCTOR DEVICE MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-08-31 EP disclosed
US-20040219372-A1 Composition for forming porous film, porous film and method for forming the same, interlevel insulator film, and semiconductor device MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. 2004-11-04 US disclosed