SCHEMBL3889962

SCHEMBL3889962

CC(C)(C)O[Al](OC(C)(C)C)OC(C)(C)C.[KH]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL107947 0.96 ALDH1A1 (0.36) ALDH1A1TSHRTDP1
Water SCHEMBL11536125 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL1939142 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL3898656 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
Lithium SCHEMBL30686180 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL590 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL28815855 0.92 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL9293250 0.88 TSHR (0.31) ALDH1A1TSHRTDP1
Lithium Ion SCHEMBL589 0.88 TSHR (0.31) ALDH1A1TSHRTDP1
Lithium Ion SCHEMBL808460 0.88 TSHR (0.31) ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572303-B2 A symmetrical dialkyl carbonate, a metal, borong, silicon, or group 7 compound, a hydrogen or hydrocarbon-based fuel, an oxidizer, and a metallic cocatalyst; minimized hydrolysis; improved combustion and storage stability OCTANE INTERNATIONAL, LTD. (US) 2009-08-11 US disclosed
EP-0954558-B1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 2006-06-14 EP disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed
EP-0254277-B1 OLIGOMERIZATION CATALYST AND OLIGOMERIZATION PROCESS UNION CARBIDE CORPORATION (US) 1993-03-17 EP disclosed
US-4822915-A METAL COMPLEXES AS POLYMERIZATION CATALYST FOR THE OLIGOMERIZATION OF ETHYLENE; CATALYST SELECTIVITY UNION CARBIDE CORPORATION (US) 1989-04-18 US disclosed
EP-0254277-A2 Oligomerization catalyst and oligomerization process UNION CARBIDE CORPORATION (US) 1988-01-27 EP disclosed
US-4716138-A REACTION PRODUCT OF TRANSITION METAL COMPOUND AND ORGANOPHOSPHORUS SULFONATE UNION CARBIDE CORPORATION (US) 1987-12-29 US disclosed
US-4689437-A ETHYLENE OR ETHYLENE-PROPYLENE, CATALYST FROM TRANSITION METAL COMPOUND, ACTIVATOR, ORGANOPHOSPHORUS SULFONATE LIGAND UNION CARBIDE CORPORATION (US) 1987-08-25 US disclosed