SCHEMBL22773183

SCHEMBL22773183

CC(C)(C)CC(C)(C)c1ccc(O)cc1.[Ni]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.95
ESR1 P03372 11/20 0.57
ESR2 Q92731 10/20 0.57
CYP3A4 P08684 5/20 0.52
LMNA P02545 1/20 0.52
TYR P14679 1/20 0.52
AR P10275 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
HTR6 P50406 1/20 0.52
ESRRG P62508 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 2/20 0.45
CYP2D6 P10635 1/20 0.45
HIF1A Q16665 1/20 0.45
MEN1 O00255 1/20 0.41

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
SCHEMBL31282065 0.98 SHBG (1.00) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL10141 0.98 SHBG (1.00) SHBGESR1ESR2CYP3A4LMNA
Hydrogen Sulfide SCHEMBL10824257 0.95 SHBG (0.95) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL28041281 0.95 SHBG (0.95) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL10785821 0.95 SHBG (0.95) SHBGESR1ESR2CYP3A4LMNA
Ethylene SCHEMBL8593493 0.93 SHBG (0.91) SHBGESR1ESR2CYP3A4LMNA
Benzene SCHEMBL29025935 0.93 SHBG (0.91) SHBGESR1ESR2CYP3A4LMNA
Formaldehyde SCHEMBL290371 0.91 SHBG (0.88) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL647964 0.91 SHBG (0.88) SHBGESR1ESR2CYP3A4LMNA
SCHEMBL7063934 0.91 SHBG (0.88) SHBGESR1ESR2CYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117362548-A Toughening agent polymerization method with high ultraviolet yellowing resistance 山东智雅新材料有限公司 2024-01-09 CN claimed
CN-108303761-B Low blue light optical film for liquid crystal display and preparation method thereof 凯鑫森(上海)功能性薄膜产业股份有限公司 2023-12-08 CN claimed
CN-115044257-B Preparation method of stable low-ice-adhesion super-lubricating anti-ice coating 中国科学院长春应用化学研究所 2023-04-07 CN claimed
CN-114937742-B Method for enhancing stability of N-type semiconductor through oxygen elimination 天津大学 2023-01-31 CN claimed
CN-115109492-A Preparation method of hydrophilic anti-ice coating 中国科学院长春应用化学研究所 2022-09-27 CN claimed
CN-115044257-A Preparation method of stable low-ice-adhesion super-lubricating anti-ice coating 中国科学院长春应用化学研究所 2022-09-13 CN claimed
CN-114937742-A Method for enhancing stability of N-type semiconductor through oxygen elimination 天津大学 2022-08-23 CN claimed
CN-114716761-A Preparation method of high-strength filaments for woven bags 安庆龙意医用新材料有限公司 2022-07-08 CN claimed
CN-113861639-A High-crack-resistance degradable modified plastic based on modified graphene and preparation method thereof 国弘晟世(上海)高新材料有限公司 2021-12-31 CN claimed
CN-107828178-B Dynamic cross-linking type weather-resistant ABS edge banding material and preparation method thereof 东莞市华立实业股份有限公司 2020-10-16 CN claimed
CN-111117786-A Anti-freezing type glass cleaning water for preventing glass from fogging and manufacturing method thereof 魅扬(湖北)科技有限公司 2020-05-08 CN claimed
CN-110591152-A Flame-retardant stabilizer, halogen-free flame-retardant glass fiber reinforced polypropylene and preparation method thereof 上海化工研究院有限公司 2019-12-20 CN claimed
CN-104119885-A Wavelength-shifting composite light-storing powder and manufacturing method and application thereof TAIWAN TEXTILE RES INST 2014-10-29 CN claimed
CN-113646052-B Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument 百乐墨水株式会社 2024-05-17 CN disclosed
CN-117946499-A Biodegradable polyester composition, biodegradable polyester material, preparation method of biodegradable polyester material, casting film, preparation method of casting film and application of casting film 中国石油化工股份有限公司 2024-04-30 CN disclosed
CN-117362548-A Toughening agent polymerization method with high ultraviolet yellowing resistance 山东智雅新材料有限公司 2024-01-09 CN disclosed
CN-1049227-C Controllably graded polyolefine plastics containing amidoalkyl ferrocene, derivative production and application SHANGHAI INST ORGANIC CHEM (CN) 2000-02-09 CN disclosed
CN-1048019-C Hydrolytically stable pentaerythritol diphosphites DOVER CHEMICAL CORP (US) 2000-01-05 CN disclosed
CN-1137798-A Hydrolytically stable pentaerythritol diphosphites DOVER CHEMICAL CORP (US) 1996-12-11 CN disclosed
CN-1090300-A A kind of controllably graded polyolefine plastics, manufacturing and application that contains aminoalkyl ferrocene derivative SHANGHAI INST ORGANIC CHEM (CN) 1994-08-03 CN disclosed