SCHEMBL599076

SCHEMBL599076

CCc1ccc2cc(C)ccc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.64
CYP2A6 P11509 4/20 0.64
TDP1 Q9NUW8 1/20 0.52
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
TRPA1 O75762 1/20 0.43
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
DAO P14920 1/20 0.38
NCK1 P16333 1/20 0.38
BACE1 P56817 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL29786773 1.00 CYP1A2 (0.64) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
Ammonia Solution, Strong SCHEMBL27937803 0.98 CYP2A6 (0.61) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
SCHEMBL18381464 0.96 CYP2A6 (0.59) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
SCHEMBL7754288 0.93 CYP2A6 (0.64) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
Ammonia Solution, Strong SCHEMBL27919130 0.91 CYP2A6 (0.61) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
SCHEMBL29407167 0.87 CYP2A6 (0.80) CYP1A2CYP2A6AKR1C3AKR1C2TRPA1
SCHEMBL347592 0.87 CYP2A6 (0.80) CYP1A2CYP2A6AKR1C3AKR1C2TRPA1
SCHEMBL3164981 0.83 CYP1A2 (0.55) CYP1A2CYP2A6TDP1AKR1C3AKR1C2
SCHEMBL6890734 0.82 CYP2A6 (0.73) CYP1A2CYP2A6AKR1C3AKR1C2TRPA1
SCHEMBL6885287 0.82 CYP2A6 (0.73) CYP1A2CYP2A6AKR1C3AKR1C2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195609-B Synthetic method of 2-methyl-6-ethyl naphthalene 中国科学院大连化学物理研究所 2022-11-25 CN claimed
CN-114195609-A Synthetic method of 2-methyl-6-ethylnaphthalene 中国科学院大连化学物理研究所 2022-03-18 CN claimed
US-5210355-A Ethylation of 2-methylnaphthalene with tri-, tetra-, or penta-ethylbenzene in the presence of a catalyst AMOCO CORPORATION (US) 1993-05-11 US claimed
JP-5032565-A None JP disclosed
JP-63023827-A None JP disclosed
CN-119504333-A Preparation method and application of 2-methyl-6-alkyl naphthalene 煤炭科学技术研究院有限公司 2025-02-25 CN disclosed
EP-3745484-B1 ORGANIC SEMICONDUCTOR ELEMENT, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, METHOD FOR PRODUCING ORGANIC SEMICONDUCTOR FILM, AND POLYMER USED THEREFOR FUJIFILM CORP (JP) 2023-09-27 EP disclosed
CN-115803311-A Method for recovering oxidation by-products 英力士美国化学公司 2023-03-14 CN disclosed
EP-4130075-A1 CURABLE RESIN COMPOSITION AND DISPLAY DEVICE Sumitomo Chemical Company, Limited (JP) 2023-02-08 EP disclosed
EP-4130074-A1 CURABLE RESIN COMPOSITION AND DISPLAY DEVICE Sumitomo Chemical Company, Limited (JP) 2023-02-08 EP disclosed
US-20220380287-A1 Solids-Liquid Separation Processes INEOS US CHEMICALS COMPANY (US) 2022-12-01 US disclosed
US-5210355-A Ethylation of 2-methylnaphthalene with tri-, tetra-, or penta-ethylbenzene in the presence of a catalyst AMOCO CORPORATION (US) 1993-05-11 US disclosed
JP-H0532565-A PRODUCTION OF 2-ETHYL-6-METHYLNAPHTHALENE NIPPON STEEL CHEM CO LTD 1993-02-09 JP disclosed
EP-0487714-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-06-03 EP disclosed
EP-0475926-A2 Oxidation of dialkyl polyaromatics to dicarboxypolyaromatics MONSANTO COMPANY (US) 1992-03-18 EP disclosed
WO-1992000260-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-01-09 WO disclosed
EP-0440250-A2 Method of preparing alkylnaphthalene compounds NIPPON SHOKUBAI CO., LTD. (JP) 1991-08-07 EP disclosed
JP-S6323827-A PRODUCTION OF 2-METHYL-6-ETHYLNAPHTHALENE SUMIKIN CHEM CO LTD 1988-02-01 JP disclosed
US-4299991-A Formation of hydroperoxides THE STANDARD OIL COMPANY (US) 1981-11-10 US disclosed
US-4152358-A FROM ALIPHATIC, AROMATIC OR ALICYCLIC HYDROCARBON IN PRESENCE OF PHOSPHATE OF URANIUM, COPPER OR IRON PETRO-TEX CHEMICAL CORPORATION (US) 1979-05-01 US disclosed