SCHEMBL2808913

SCHEMBL2808913

C=CCc1ccc2sc3ccccc3c2c1CC=C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
DUSP3 P51452 1/20 0.36
BLM P54132 1/20 0.36
PTPN5 P54829 1/20 0.36
KMT2A Q03164 1/20 0.36
PTPN11 Q06124 1/20 0.36
MCL1 Q07820 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPY1R P25929 1/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 2/20 0.33
CYP1A2 P05177 2/20 0.33
NPC1 O15118 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL7599759 0.88 MAPT (0.44) GPR3MAPTMEN1POLBDUSP3
SCHEMBL5460621 0.83 GPR3 (0.38) GPR3MAPTMEN1POLBDUSP3
SCHEMBL176274 0.82 GPR3 (0.48) GPR3MAPTMEN1POLBDUSP3
SCHEMBL5460623 0.81 GPR3 (0.47) GPR3MAPTMEN1POLBDUSP3
SCHEMBL28612371 0.76 MAPT (0.43) GPR3MAPTMEN1POLBDUSP3
SCHEMBL1395327 0.74 MAPT (0.43) GPR3MAPTMEN1POLBKMT2A
SCHEMBL31120488 0.74 MAPT (0.43) GPR3MAPTMEN1POLBKMT2A
SCHEMBL5346693 0.73 MAPT (0.43) GPR3MAPTMEN1POLBDUSP3
SCHEMBL232235 0.72 GPR3 (0.43) GPR3MAPTMEN1POLBDUSP3
SCHEMBL11175697 0.72 GPR3 (0.43) GPR3MAPTMEN1POLBDUSP3

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615145-B2 One-pot process for the reduction of sulfur, nitrogen and the production of useful oxygenates from hydrocarbon materials via one-pot selective oxidation KOCAT INC. (KR) 2009-11-10 US claimed
US-7591943-B2 desulfurization, denitrification and producing hydrocarbon oxidates by reacting with oxidant in presence of homogeneous oxidation catalyst and hydrobromide mixtures; gasoline with improved oxidant rating, cetane number KOCAT INC. (KR) 2009-09-22 US claimed
US-20080149533-A1 ONE-POT PROCESS FOR THE REDUCTION OF SULFUR, NITROGEN AND THE PRODUCTION OF USEFUL OXYGENATES FROM HYDROCARBON MATERIALS VIA ONE-POT SELECTIVE OXIDATION KOCAT INC. (KR) 2008-06-26 US claimed
US-20080121565-A1 PROCESS FOR THE REDUCTION OF SULFUR, NITROGEN AND THE PRODUCTION OF USEFUL OXYGENATES FROM HYDROCARBON MATERIALS VIA ONE-POT SELECTIVE OXIDATION KOCAT INC. (KR) 2008-05-29 US claimed
EP-1911830-A1 Process for the reduction of sulfur, nitrogen and the production of useful oxygenates from hydrocarbon materials via one-pot selective oxidation Kocat Inc. (KR) 2008-04-16 EP claimed
EP-1911831-A1 One-pot process for the reduction of sulfur, nitrogen and the production of useful oxygenates from hydrocarbon materials via one-pot selective oxidation Kocat Inc. (KR) 2008-04-16 EP claimed
US-7309416-B2 Methods and compositions for desulfurization of hydrocarbon fuels ASPEN PRODUCTS GROUP, INC. (US) 2007-12-18 US claimed
US-20070175798-A1 METHODS AND COMPOSITIONS FOR DESULFURIZATION OF HYDROCARBON FUELS ASPEN PRODUCTS GROUP, INC. 2007-08-02 US claimed
WO-2005007780-A2 METHODS AND COMPOSITIONS FOR DESULFURIZATION OF HYDROCARBON FUELS ASPEN PRODUCTS GROUP, INC. (US) 2005-01-27 WO claimed
US-9809765-B2 Process for producing transportation fuels from oil sands-derived crude EPIC OIL EXTRACTORS, LLC (US) 2017-11-07 US disclosed
US-9790441-B2 Process for producing transportation fuels from oil sands-derived crude EPIC OIL EXTRACTORS, LLC (US) 2017-10-17 US disclosed
WO-2015048588-A1 PROCESS FOR PRODUCING TRANSPORTATION FUELS FROM OIL SANDS-DERIVED CRUDE EPIC OIL EXTRACTORS, LLC (US) 2015-04-02 WO disclosed
US-20150090634-A1 PROCESS FOR PRODUCING TRANSPORTATION FUELS FROM OIL SANDS-DERIVED CRUDE EPIC OIL EXTRACTORS, LLC (US) 2015-04-02 US disclosed
WO-2015048649-A1 PROCESS FOR PRODUCING TRANSPORTATION FUELS FROM OIL SANDS-DERIVED CRUDE EPIC OIL EXTRACTORS, LLC (US) 2015-04-02 WO disclosed
WO-2005007780-A2 METHODS AND COMPOSITIONS FOR DESULFURIZATION OF HYDROCARBON FUELS ASPEN PRODUCTS GROUP, INC. (US) 2005-01-27 WO disclosed
EP-0991736-B8 METHOD FOR SEPARATING BENZOTHIOPHENE COMPOUNDS FROM A HYDROCARBON MIXTURE CONTAINING THEM CENTRE NAT RECH SCIENT (FR) 2003-05-07 EP disclosed
EP-0991736-B1 METHOD FOR SEPARATING BENZOTHIOPHENE COMPOUNDS FROM A HYDROCARBON MIXTURE CONTAINING THEM CENTRE NAT RECH SCIENT (FR) 2003-01-29 EP disclosed
US-6441264-B1 COMPLEXING OF HYDROCARBONS; SOLVENT EXTRACTION; PURIFICATIONBENZOTHIOPHENE COMPOUND TOTAL RAFFINAGE DISTRIBUTION S.A. (FR) 2002-08-27 US disclosed
EP-0991736-A1 METHOD FOR SEPARATING BENZOTHIOPHENE COMPOUNDS FROM A HYDROCARBON MIXTURE CONTAINING THEM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2000-04-12 EP disclosed
WO-1998056875-A1 METHOD FOR SEPARATING BENZOTHIOPHENE COMPOUNDS FROM A HYDROCARBON MIXTURE CONTAINING THEM, AND HYDROCARBON MIXTURE OBTAINED BY SAID METHOD CNRS-CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-12-17 WO disclosed