SCHEMBL3900215

SCHEMBL3900215

Cc1cccc(OB(O)c2cccc(C)c2C)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
HTR1B P28222 1/20 0.39
ENPP2 Q13822 1/20 0.38
POLB P06746 3/20 0.38
TRPA1 O75762 1/20 0.38
ATM Q13315 1/20 0.38
ORAI1 Q96D31 1/20 0.37
ORAI2 Q96SN7 1/20 0.37
ORAI3 Q9BRQ5 1/20 0.37
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KEAP1 Q14145 1/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 0.35
NR4A1 P22736 1/20 0.35

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
SCHEMBL30338488 0.82 MAPT (0.47) MAPTHTR1BPOLBTRPA1ATM
SCHEMBL457239 0.82 MAPT (0.47) MAPTHTR1BPOLBTRPA1ATM
SCHEMBL3889703 0.80 MAPT (0.46) MAPTHTR1BPOLBTRPA1ATM
SCHEMBL3783711 0.77 TRPA1 (0.40) MAPTENPP2TRPA1ATMALDH1A1
SCHEMBL28136580 0.77 TRPA1 (0.40) MAPTENPP2TRPA1ATMORAI1
SCHEMBL5987894 0.77 ENPP2 (0.45) ENPP2ORAI1ORAI2ORAI3ALDH1A1
SCHEMBL29703714 0.76 MAPT (0.48) MAPTHTR1BPOLBTRPA1ATM
SCHEMBL457237 0.76 MAPT (0.48) MAPTHTR1BPOLBTRPA1ATM
SCHEMBL309076 0.75 TRPA1 (0.50) MAPTENPP2TRPA1ATMALDH1A1
SCHEMBL29479067 0.75 TRPA1 (0.50) MAPTENPP2TRPA1ATMALDH1A1

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 11 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
WO-2006076020-A2 FUEL COMPOSITIONS AND METHODS THEREOF FERNANDES JOSEPH B (US) 2006-07-20 WO disclosed
EP-0954558-B1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 2006-06-14 EP disclosed
US-20050229479-A1 Fuel compositions and methods thereof ETANE USA, L.L.C. 2005-10-20 US 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