SCHEMBL331127

SCHEMBL331127

CC(C)Cc1cccc2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.54
GABRB2 P47870 1/20 0.54
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.52
CTNNB1 P35222 1/20 0.51
SIGMAR1 Q99720 2/20 0.51
TDP1 Q9NUW8 1/20 0.47
ADRB2 P07550 4/20 0.47
ACP3 P15309 1/20 0.46
MME P08473 1/20 0.45
ACE P12821 1/20 0.45

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
SCHEMBL10456006 0.98 GABRA1 (0.52) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
SCHEMBL10456008 0.98 GABRA1 (0.52) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
Sulfuric Acid SCHEMBL1289313 0.89 CTNNB1 (0.51) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
SCHEMBL10630320 0.88 HPRT1 (0.52) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
Sulfuric Acid SCHEMBL1282450 0.88 CTNNB1 (0.46) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
SCHEMBL7528890 0.87 CYP1A2 (0.53) CYP1A2CYP2C19CYP2D6CYP2C9CTNNB1
SCHEMBL23527437 0.86 GABRA1 (0.62) GABRA1GABRB2CYP1A2CYP2C19CYP2D6
SCHEMBL6307855 0.83 CTNNB1 (0.53) CYP1A2CYP2C19CYP2D6CYP2C9CTNNB1
SCHEMBL10355407 0.83 CTNNB1 (0.53) CYP1A2CYP2C19CYP2D6CYP2C9CTNNB1
SCHEMBL4817621 0.83 CYP1A2 (0.50) CYP1A2CYP2C19CYP2D6CYP2C9CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3132010-B1 DIELECTRIC LIQUIDS CONTAINING CERTAIN AROMATIC COMPOUNDS AS VISCOSITY-REDUCING ADDITIVES NYNAS AB PUBL (SE) 2022-02-02 EP claimed
CN-111434658-A Organic electroluminescent materials and devices 机光科技股份有限公司 2020-07-21 CN claimed
EP-3132010-A1 USE OF CERTAIN AROMATIC COMPOUNDS AS ADDITIVES TO A DIELECTRIC LIQUID FOR RE-DUCING THE VISCOSITY THEREOF Nynas AB (publ) (SE) 2017-02-22 EP claimed
EP-2092535-B1 ENERGY CABLE PRYSMIAN SPA (IT) 2017-01-18 EP claimed
WO-2015122830-A1 USE OF CERTAIN AROMATIC COMPOUNDS AS ADDITIVES TO A DIELECTRIC LIQUID FOR RE-DUCING THE VISCOSITY THEREOF NYNAS AB (PUBL) (SE) 2015-08-20 WO claimed
US-8378216-B2 Energy cable PRYSMIAN S.P.A. (IT) 2013-02-19 US claimed
US-20100126756-A1 ENERGY CABLE PRYSMIAN CAVIESISTEMI ENERGIA (IT) 2010-05-27 US claimed
EP-2092535-A1 ENERGY CABLE Prysmian S.p.A. (IT) 2009-08-26 EP claimed
WO-2008058572-A1 ENERGY CABLE PRYSMIAN S.P.A. (IT) 2008-05-22 WO claimed
EP-0599448-B1 Solvant for use in carbonless paper, comprising diisopropylmethylnaphthalene, and products utilising same KOCH IND INC (US) 1998-04-29 EP claimed
US-5489332-A MIXTURE KOCH INDUSTRIES, INC. (US) 1996-02-06 US claimed
EP-0599448-A2 Solvant for use in carbonless paper, comprising diisopropylmethylnaphthalene, and products utilising same KOCH INDUSTRIES, INC. (US) 1994-06-01 EP claimed
US-5310855-A Aromatic condensation products BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US claimed
EP-0188969-B1 PROCESS AND COMPOSITION FOR PREVENTING THE AGGLOMERATION OF NON-POWDERY SALTS AND FERTILIZERS COMPAGNIE FRANCAISE DE PRODUITS INDUSTRIELS (FR) 1989-12-06 EP claimed
EP-0188969-A1 Process and composition for preventing the agglomeration of non-powdery salts and fertilizers COMPAGNIE FRANCAISE DE PRODUITS INDUSTRIELS (FR) 1986-07-30 EP claimed
JP-11139999-A None JP disclosed
CN-110437046-B Fluorine atom-containing polymer and field of use thereof 日产化学工业株式会社 2022-08-16 CN disclosed
US-4031106-A Synthesis of aromatic amines by reaction of aromatic compounds with ammonia E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-06-21 US disclosed
US-4001260-A NICKEL-NICKEL OXIDE-ZIRCONIUM OXIDE AMINATION CATALYST E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-01-04 US disclosed
US-3996149-A SILICA BURKE OLIVER W JUN 1976-12-07 US disclosed