SCHEMBL2641096

SCHEMBL2641096

C=CCc1ccc(O)c(C(C)(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.61
GABRA1 P14867 9/20 0.59
GABRB2 P47870 9/20 0.59
ALDH1A1 P00352 5/20 0.59
CNR2 P34972 3/20 0.59
MAPT P10636 3/20 0.59
MEN1 O00255 2/20 0.59
GAA P10253 2/20 0.59
CNR1 P21554 2/20 0.59
KMT2A Q03164 2/20 0.59
KDM4E B2RXH2 2/20 0.59
PPARG P37231 2/20 0.59
PPARD Q03181 2/20 0.59
ALDH2 P05091 1/20 0.59
AKR1B1 P15121 1/20 0.59
HPGD P15428 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ALOX5 P09917 6/20 0.56
CYP3A4 P08684 1/20 0.56
AR P10275 1/20 0.56

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
SCHEMBL6379196 0.87 XDH (0.63) XDHGABRA1GABRB2ALDH1A1CNR2
SCHEMBL2338216 0.84 ALDH1A1 (0.52) XDHGABRA1GABRB2ALDH1A1CNR2
SCHEMBL9211827 0.83 ALDH1A1 (0.47) XDHGABRA1GABRB2ALDH1A1CNR2
SCHEMBL11276926 0.82 XDH (0.61) XDHGABRA1GABRB2ALDH1A1CNR2
SCHEMBL28179323 0.81 ALDH1A1 (0.52) XDHALDH1A1MAPTMEN1GAA
SCHEMBL9177196 0.79 ALDH1A1 (0.55) ALDH1A1MAPTMEN1GAAKMT2A
SCHEMBL463408 0.79 ALDH1A1 (0.53) ALDH1A1MAPTMEN1GAAKMT2A
SCHEMBL2919862 0.79 ALDH1A1 (0.59) ALDH1A1MAPTMEN1GAAKMT2A
SCHEMBL31146612 0.79 ALDH1A1 (0.59) ALDH1A1MAPTMEN1GAAKMT2A
SCHEMBL7199857 0.79 ALDH1A1 (0.59) ALDH1A1CNR2MAPTGAACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114630888-A Method for reducing malodor on fabrics 宝洁公司 2022-06-14 CN claimed
CN-110114448-B Lubricating composition with alkylated naphthylamines 路博润公司 2022-03-04 CN claimed
EP-3562922-B1 LUBRICATING COMPOSITION WITH ALKYLATED NAPHTHYLAMINE LUBRIZOL CORP (US) 2021-02-03 EP claimed
WO-2014174106-A1 VACUUM PUMP OIL SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2014-10-30 WO claimed
EP-0611748-A1 Propanolamine derivatives and their use as hypotensive or antiglaucoma agents Senju Pharmaceutical Co., Ltd. (JP) 1994-08-24 EP claimed
US-5237074-A Diels-alder reaction using maleic anhydride NEW JAPAN CHEMICAL CO., LTD. (JP) 1993-08-17 US claimed
US-4301311-A BY REACTING DICYCLOPENTADIENE WITH A 2-TERT-BUTYLPHENOL IN THE PRESENCE OF A SOLVENT CHEMISCHE WERKE LOWI GMBH (DE) 1981-11-17 US claimed
US-4219570-A Insect repellents and a method of repelling insects AJINOMOTO COMPANY, INCORPORATED (JP) 1980-08-26 US claimed
JP-62018445-A None JP disclosed
CN-115894391-B Hindered phenol antioxidant, preparation method thereof, ABS emulsion type antioxidant composition and ABS resin prepared from ABS emulsion type antioxidant composition 万华化学集团股份有限公司 2024-11-12 CN disclosed
EP-3688126-B1 LUBRICATING OIL COMPOSITION FOR INTERNAL COMBUSTION ENGINE SHELL INT RESEARCH (NL) 2024-06-12 EP disclosed
CN-116601138-A Reaction products of organic amines and glycidol and their use as friction modifiers 亨斯迈石油化学有限责任公司 2023-08-15 CN disclosed
CN-115894391-A Hindered phenol antioxidant and preparation method thereof, ABS emulsion type antioxidant composition and ABS resin prepared from ABS emulsion type antioxidant composition 万华化学集团股份有限公司 2023-04-04 CN disclosed
CN-115605374-A Condition monitoring of heat transfer fluids for electrical systems 埃克森美孚技术与工程公司(US) 2023-01-13 CN disclosed
EP-0174277-B1 ANTI-OXIDANT COMPOSITONS FOR ORGANIC MATERIAL CIBA-GEIGY AG (CH) 1988-04-06 EP disclosed
JP-S6218445-A BUTADIENE POLYMER COMPOSITION SUMITOMO CHEM CO LTD 1987-01-27 JP disclosed
EP-0174277-A1 Anti-oxidant compositons for organic material CIBA-GEIGY AG (CH) 1986-03-12 EP disclosed
EP-0102502-A1 Process for producing a moulded part of polyvinylbutyral HOECHST AKTIENGESELLSCHAFT (DE) 1984-03-14 EP disclosed
US-4301311-A BY REACTING DICYCLOPENTADIENE WITH A 2-TERT-BUTYLPHENOL IN THE PRESENCE OF A SOLVENT CHEMISCHE WERKE LOWI GMBH (DE) 1981-11-17 US disclosed
US-4301311-A BY REACTING DICYCLOPENTADIENE WITH A 2-TERT-BUTYLPHENOL IN THE PRESENCE OF A SOLVENT CHEMISCHE WERKE LOWI GMBH (DE) 1981-11-17 US disclosed