SCHEMBL3274433

SCHEMBL3274433

CC(C)(C)c1cc(-c2cccc3[nH]nnc23)c(O)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.44
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
CA2 P00918 1/20 0.34
PTPN5 P54829 1/20 0.33
GRM4 Q14833 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
NR2F2 P24468 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL30940341 1.00 HSP90AA1 (0.44) HSP90AA1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL29617965 1.00 HSP90AA1 (0.44) HSP90AA1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL29017738 0.97 HSP90AA1 (0.42) HSP90AA1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL30426548 0.97 HSP90AA1 (0.42) HSP90AA1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL10432050 0.90 MEN1 (0.34) HSP90AA1CYP3A4CYP2C9CYP2C19CA2
SCHEMBL28957322 0.90 GABRA1 (0.34) HSP90AA1CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL5070152 0.87 CA2 (0.44) CYP2C9CYP2C19CYP1A2CA2PTPN5
SCHEMBL31282273 0.87 CA2 (0.44) CYP2C9CYP2C19CYP1A2CA2PTPN5
SCHEMBL3193122 0.86 CYP2C19 (0.34) HSP90AA1CYP3A4CYP2C9CYP2C19GRM4
SCHEMBL7143644 0.85 CA2 (0.47) TSHRCA2PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820819-A Electronic grade weather-resistant epoxy resin composition, and preparation method and application thereof 安徽美佳新材料股份有限公司 2024-04-05 CN claimed
CN-116675974-A Polycarbonate composition, polycarbonate material, secondary battery, and electric device 宁德时代新能源科技股份有限公司 2023-09-01 CN claimed
CN-114907517-B Layer thickness controllable electrolyte, slurry and preparation method of honeycomb solid oxide fuel cell 上海应用技术大学 2023-07-28 CN claimed
CN-111777759-B Catechol compound modified polyether, preparation method thereof and application thereof in improving adhesive strength of adhesive 江苏苏博特新材料股份有限公司 2023-05-05 CN claimed
CN-115991970-A Reactive polyurethane hot melt adhesive for automobile spare tire cover plate and preparation method thereof 康达新材料(集团)股份有限公司 2023-04-21 CN claimed
CN-115678482-A Reactive polyurethane hot melt adhesive for bags and preparation method thereof 康达新材料(集团)股份有限公司 2023-02-03 CN claimed
CN-115595109-A Reactive polyurethane hot melt adhesive for sealing car lamp and preparation method thereof 康达新材料(集团)股份有限公司(CN) 2023-01-13 CN claimed
CN-115521693-A Preparation method of UV-resistant flame-retardant waterproof polyurethane resin and high-grade calf leather 兴业皮革科技股份有限公司 2022-12-27 CN claimed
CN-115449570-A Preparation method and application of sulfonated UV-resistant retanning agent based on collagen 兴业皮革科技股份有限公司 2022-12-09 CN claimed
CN-114920986-A Ultraviolet blocking agent and preparation and application methods thereof 万凯新材料股份有限公司 2022-08-19 CN claimed
CN-111019582-B Reactive polyurethane hot melt adhesive for household appliance sealing and preparation method thereof 康达新材料(集团)股份有限公司 2022-04-01 CN claimed
CN-108018018-B Low-modulus high-elasticity-recovery-rate polyurethane sealant and preparation method thereof 江苏苏博特新材料股份有限公司 2021-04-20 CN claimed
CN-111777759-A Catechol compound modified polyether, preparation method thereof and application thereof in improving adhesive bonding strength 江苏苏博特新材料股份有限公司 2020-10-16 CN claimed
CN-111019582-A Reactive polyurethane hot melt adhesive for household appliance sealing and preparation method thereof 上海康达化工新材料集团股份有限公司 2020-04-17 CN claimed
CN-108207443-B PE mulching film 东莞市正新包装制品有限公司 2020-01-24 CN claimed
CN-106087243-B A kind of filter felt and preparation method thereof of polyimides and polysulfonamides blending 中材装备集团有限公司 2018-07-27 CN claimed
CN-106087243-A Filter felt that a kind of polyimides and polysulfonamides are blended and preparation method thereof 中材装备集团有限公司 2016-11-09 CN claimed
CN-118354987-A Interlayer for laminated glass and laminated glass 积水化学工业株式会社 2024-07-16 CN disclosed
US-4368258-A HYDROPHOBIC SUBSTANCE, WATER-MISCIBLE SOLVENT KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1983-01-11 US disclosed
US-4232118-A METHINECYANINE DYES KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1980-11-04 US disclosed