SCHEMBL3468016

SCHEMBL3468016

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

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.52
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2B6 P20813 1/20 0.47
CYP2C19 P33261 1/20 0.47
GAA P10253 1/20 0.46
XBP1 P17861 1/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
IAPP P10997 1/20 0.45
DGKA P23743 1/20 0.44
KAT8 Q9H7Z6 2/20 0.44
CNR1 P21554 2/20 0.44
HTR1A P08908 2/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL9168908 1.00 APP (0.52) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL2184521 1.00 APP (0.52) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL9169755 1.00 APP (0.52) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL5527871 0.95 APP (0.57) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL439039 0.90 DGKA (0.50) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL4638212 0.87 APP (0.49) APPCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL3250259 0.87 GAA (0.49) GAADGKACNR1CNR2
SCHEMBL13899816 0.86 GAA (0.53) GAADGKACNR1CNR2
SCHEMBL754404 0.86 GAA (0.53) GAADGKACNR1CNR2
SCHEMBL208070 0.86 GAA (0.53) GAADGKACNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113429788-A PPSU reclaimed material and preparation process thereof 日彩复合塑料(深圳)有限公司 2021-09-24 CN claimed
CN-115943468-B Magnetic resin composition for injection molding and injection molded article for magnetic shielding 爱天思株式会社 2024-06-28 CN disclosed
CN-114026138-B Acrylic rubber having excellent storage stability 日本瑞翁株式会社 2024-03-19 CN disclosed
CN-115341337-B Preparation process and application of fluffy heat storage melt-blown material 称道新材料科技(上海)有限公司 2024-01-30 CN disclosed
EP-4306578-A1 SURFACE MEMBER OF EXTERIOR FLOORING, AND METHOD FOR PRODUCING SAME Sekisui Chemical Co., Ltd. (JP) 2024-01-17 EP disclosed
CN-115943468-A Magnetic resin composition for injection molding and injection molded article for magnetic shield 东洋油墨SC控股株式会社 2023-04-07 CN disclosed
CN-112449649-B Adhesive and adhesive sheet 东洋油墨SC控股株式会社 2022-10-21 CN disclosed
CN-114989625-A Method for preparing wood plastic by mixing waste high polymer material and straw 江西瑞京鸿兴实业有限公司 2022-09-02 CN disclosed
CN-115003711-A Resin fine particles and method for producing same 积水化成品工业株式会社 2022-09-02 CN disclosed
CN-113429788-B PPSU reclaimed material and preparation process thereof 日彩复合塑料(深圳)有限公司 2022-08-16 CN disclosed
EP-0335262-B1 Phosphite compounds YOSHITOMI PHARMACEUTICAL (JP) 1995-05-31 EP disclosed
US-5077424-A Antioxidants YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-12-31 US disclosed
US-4938955-A Antibiotic resin composition Shingawa Fuel Co., Ltd (JP) 1990-07-03 US disclosed
US-4931504-A HIGH IMPACT STRENGTH AND HIGH SOFTENING TEMPERATURE HULS AKTIENGESELLSCHAFT (DE) 1990-06-05 US disclosed
EP-0335262-A2 Phosphite compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-10-04 EP disclosed
US-4690978-A MOLDING COMPOSITION HAVING HIGH IMPACT STRENGTH HULS AKTIENGESELLSCHAFT (DE) 1987-09-01 US disclosed
US-4652491-A BUTADIENE-STYRENE COPOLYMER, ROSIN ESTER TACKIFIER; DIAPER CLOSURE TAPE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-03-24 US disclosed
US-4616075-A Storage of guayule by densification THE FIRESTONE TIRE & RUBBER COMPANY (US) 1986-10-07 US disclosed
US-3991002-A RUBBERY BLOCK COPOLYMERS AND THERMOPLASTIC RESINS, RECEPTIVITY TO PRESSURE-SENSITIVE ADHESIVES MINNESOTA MINING AND MANUFACTURING COMPANY (MN) 1976-11-09 US disclosed
US-3962123-A PHENOLIC ANTIOXIDANT AQUEOUS DISPERSIONS CIBA-GEIGY CORPORATION (US) 1976-06-08 US disclosed