SCHEMBL3898460

SCHEMBL3898460

N[SiH](N)OCCC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.43
SIGMAR1 Q99720 3/20 0.40
CYP1A2 P05177 1/20 0.38
MCHR1 Q99705 1/20 0.33
METAP1 P53582 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CCNA1 P78396 1/20 0.33
EPHX1 P07099 1/20 0.33
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL5400759 0.77 CYP1A2 (0.43) NFE2L2SIGMAR1CYP1A2EPHX1
SCHEMBL6356808 0.76 SLC1A3 (0.36) SIGMAR1
SCHEMBL28653753 0.74 CYP1A2 (0.45) NFE2L2SIGMAR1CYP1A2MCHR1EPHX1
SCHEMBL17577931 0.73 NFE2L2 (0.47) NFE2L2SIGMAR1CYP1A2MCHR1METAP1
SCHEMBL1715770 0.73 NFE2L2 (0.47) NFE2L2SIGMAR1CYP1A2MCHR1METAP1
SCHEMBL8743871 0.72 CYP1A2 (0.46) NFE2L2SIGMAR1CYP1A2MCHR1METAP1
SCHEMBL11224710 0.72 CYP1A2 (0.46) NFE2L2SIGMAR1CYP1A2MCHR1METAP1
SCHEMBL21938959 0.70 CYP1A2 (0.44) NFE2L2SIGMAR1CYP1A2MCHR1METAP1
SCHEMBL14553127 0.70
SCHEMBL1715570 0.70

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 9 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