SCHEMBL29349883

SCHEMBL29349883

Cc1cc(C(C)C(=O)OCCOCCOCCOC(=O)C(C)c2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CYP2D6 P10635 1/20 0.36
SERPINE1 P05121 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CA2 P00918 1/20 0.34
POLB P06746 1/20 0.34
TYR P14679 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GLRA3 O75311 1/20 0.34
GLRB P48167 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
HMGCR P04035 1/20 0.34
GAA P10253 2/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
MT-CO2 P00403 1/20 0.33
CACNA1A O00555 1/20 0.33
CACNA2D1 P54289 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
SCHEMBL379324 1.00 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19CYP2D6SERPINE1
SCHEMBL29405981 1.00 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19CYP2D6SERPINE1
SCHEMBL19950694 0.96 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19CYP2D6ALDH1A1
SCHEMBL10920113 0.88 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19CYP2D6ALDH1A1
SCHEMBL6056065 0.87 CA2 (0.42) CYP1A2CYP2D6ALDH1A1CA2POLB
SCHEMBL283440 0.86 CYP1A2 (0.39) CYP1A2CYP2C9CYP2C19CYP2D6ALDH1A1
SCHEMBL1434835 0.85 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19CYP2D6SERPINE1
SCHEMBL5492112 0.85 CYP1A2 (0.42) CYP1A2CYP2C9CYP2C19CYP2D6ALDH1A1
SCHEMBL25309298 0.85 ESR1 (0.50) CYP1A2CYP2C9CYP2C19
SCHEMBL284544 0.85 ESR1 (0.50) CYP1A2CYP2C9CYP2C19

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
CN-114269805-A Process for preparing polyisocyanate compositions 韩华思路信(株) 2022-04-01 CN claimed
WO-2025215194-A1 ENHANCED REMOVABILITY OF NAIL COATINGS USING ACIDIC COPOLYMERS FOR TRIGGERED REMOVAL WITH AQUEOUS BASED REMOVER ARKEMA FRANCE (FR) 2025-10-16 WO disclosed
WO-2025215192-A1 LIQUID ZINC ACRYLATE COMPLEXES USED IN DEINKING PROCESS ARKEMA FRANCE (FR) 2025-10-16 WO disclosed
CN-119907820-A Isocyanate composition 韩华思路信(株) 2025-04-29 CN disclosed
US-20250092225-A1 THERMOPLASTIC POLYURETHANE PRECURSOR, AND THERMOPLASTIC POLYURETHANE, METHOD OF MANUFACTURING THE SAME AND USES OF THE SAME CHITEC TECHNOLOGY CO., LTD. (TW) 2025-03-20 US disclosed
EP-4520773-A1 THERMOPLASTIC POLYURETHANE PRECURSOR, AND THERMOPLASTIC POLYURETHANE AND PREPARATION METHOD THEREFOR AND USE THEREOF Chitec Technology Co., Ltd. (TW) 2025-03-12 EP disclosed
CN-114144163-B Nail coating based on photocurable composition 阿科玛法国公司 2025-02-18 CN disclosed
CN-118055972-B Resin composition for heat-dissipating gap filler, and article 东京油墨株式会社 2024-11-19 CN disclosed
WO-2024205379-A1 ISOCYANATE COMPOSITION 한화솔루션 주식회사 2024-10-03 WO disclosed
CN-118055972-A Resin composition for heat-dissipating gap filler, and article 东京油墨株式会社 2024-05-17 CN disclosed
CN-112423910-B Articles prepared using curable compositions based on polymerizable ionic species 阿科玛法国公司 2022-09-13 CN disclosed
CN-106716236-B Backlight unit, liquid crystal display device, and wavelength conversion member 富士胶片株式会社 2022-09-09 CN disclosed
CN-109937323-B Light-absorbing film and backlight unit 富士胶片株式会社 2022-06-24 CN disclosed
WO-2022131284-A1 FLAME RETARDANT AGENT COMPOSITION, FLAME-RETARDANT RESIN COMPOSITION, AND MOLDED BODY 株式会社ADEKA 2022-06-23 WO disclosed
CN-112272687-B Phosphate amine salt composition, phosphate amine salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2022-06-10 CN disclosed
WO-2022118751-A1 AMINE RESISTANCE IMPARTING AGENT FOR VINYL CHLORIDE RESIN 株式会社ADEKA 2022-06-09 WO disclosed
CN-114341239-A Liquid crystal polymer film, method for producing same, flexible copper-clad laminate, and flexible printed wiring board 富士胶片株式会社 2022-04-12 CN disclosed
CN-114269805-A Process for preparing polyisocyanate compositions 韩华思路信(株) 2022-04-01 CN disclosed
CN-111094515-B Flame retardant composition, flame-retardant resin composition containing the same, and molded article of the flame-retardant resin composition 株式会社艾迪科 2022-03-11 CN disclosed
CN-113966359-A Additive composition 株式会社艾迪科 2022-01-21 CN disclosed