SCHEMBL1263571

SCHEMBL1263571

CCCc1ccc(C)c(CCC)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
ALOX5 P09917 2/20 0.44
SKP2 Q13309 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
VDR P11473 1/20 0.40
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
BACE1 P56817 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CA2 P00918 1/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL11366365 0.90 SKP2 (0.56) CNR1CNR2SKP2TAAR1CYP3A4
SCHEMBL9656290 0.89 CNR1 (0.45) CNR1CNR2ALOX5SKP2TAAR1
SCHEMBL18007124 0.87 CNR1 (0.48) CNR1CNR2ALOX5SKP2TAAR1
SCHEMBL4416400 0.85 TAAR1 (0.47) CNR1CNR2ALOX5SKP2TAAR1
SCHEMBL25814708 0.85 TAAR1 (0.38) CNR1CNR2ALOX5SKP2TAAR1
SCHEMBL11366320 0.83 SKP2 (0.58) SKP2TAAR1CYP3A4CYP2D6CYP2C9
SCHEMBL12672918 0.82 TAAR1 (0.36) CNR1CNR2ALOX5SKP2TAAR1
SCHEMBL598650 0.81 CNR1 (0.50) CNR1CNR2ALOX5SKP2LPL
SCHEMBL9740304 0.81 CNR1 (0.50) CNR1CNR2ALOX5SKP2LPL
SCHEMBL7169112 0.81 SKP2 (0.52) SKP2LPLLIPGCYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1706471-B1 PROCESS FOR THE CATALYTIC HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS VERSALIS SPA (IT) 2019-05-08 EP claimed
EP-2046920-B1 PROCESS FOR THE HIGHLY SELECTIVE HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS VERSALIS SPA (IT) 2016-06-08 EP claimed
US-8168844-B2 Catalytic compositions for the highly selective hydrodealkylation of alkylaromatic hydrocarbons POLIMERI EUROPA S.P.A. (IT) 2012-05-01 US claimed
EP-1727878-B1 PROCESS FOR THE SELECTIVE CATALYTIC HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS POLIMERI EUROPA SPA (IT) 2011-04-06 EP claimed
US-7880045-B2 in the presence of hydrogen, with a ZSM-5 zeolite catalyst which is modified with metal selected of molybdenum, zinc, nickel, cobalt, palladium; producing benzene, toluene and ethane POLIMERI EUROPA S.P.A. (IT) 2011-02-01 US claimed
US-7723554-B2 Catalytic hydrodealkylation of C8-C13 alkylaromatic hydrocarbonsmixed with C4-C9 aliphatic/cycloaliphatic products which comprisesthe continuous treatment in water with a catalyst of a ZSM-5 zeolite carrier modified with a metal from groups IIb, VIB and VIII; heating; pressurization POLIMERI EUROPA S.P.A. (IT) 2010-05-25 US claimed
US-20090272672-A1 CATALYTIC COMPOSITIONS FOR THE HIGHLY SELECTIVE HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS POLIMERI EUROPA S.P.A. (IT) 2009-11-05 US claimed
JP-2007530466-A 2007-11-01 JP claimed
US-20070203378-A1 Process For The Selective Catalytic Hydrodealkylation Of Alkylaromatic Hydrocarbons POLIMERI EUROPA S.P.A. (IT) 2007-08-30 US claimed
US-20070203377-A1 Process For The Catalytic Hydrodealkylation Of Alkylaromatic Hydrocarbons POLIMERI EUROPA S.P.A. (IT) 2007-08-30 US claimed
JP-2007518856-A 2007-07-12 JP claimed
EP-1727878-A1 PROCESS FOR THE SELECTIVE CATALYTIC HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS Polimeri Europa S.p.A. (IT) 2006-12-06 EP claimed
EP-1706471-A1 PROCESS FOR THE CATALYTIC HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS Polimeri Europa S.p.A. (IT) 2006-10-04 EP claimed
WO-2005090525-A1 PROCESS FOR THE SELECTIVE CATALYTIC HYDRODEALKYLATION OF ALKYLAROMATIC HYDROCARBONS POLIMERI EUROPA S.P.A. (IT) 2005-09-29 WO claimed
WO-2005071045-A1 PROCESS FOR THE CATALYTIC HYDRODEALKYLATION OF ALKYLARO­MATIC HYDROCARBONS POLIMERI EUROPA S.P.A. (IT) 2005-08-04 WO claimed
US-4227027-A ADDUCT WITH A POLYHYDRIC ALCOHOL, ALKYLATION ALLIED CHEMICAL CORPORATION (US) 1980-10-07 US disclosed
US-4209654-A ADDUCT WITH POLYHYDRIC ALCOHOLS ALLIED CHEMICAL CORPORATION (US) 1980-06-24 US disclosed
EP-0010372-A1 Recyclable boron trifluoride catalyst and method of using same ALLIED CORPORATION (US) 1980-04-30 EP disclosed