SCHEMBL576991

SCHEMBL576991

O=C1OCCCC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP19A1 P11511 7/20 0.42
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTRB1 P17538 1/20 0.39
CTRC Q99895 1/20 0.38
CFTR P13569 1/20 0.37
GOPC Q9HD26 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
IGF1R P08069 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL576404 0.94 TP53 (0.41) TP53L3MBTL1CYP19A1DDB1CRBN
Alpha-Phenyl-Gamma-Butyrolactone SCHEMBL6771142 0.88 CYP19A1 (0.44) CYP19A1DDB1CRBNCTRB1CTRC
Alpha-Phenyl-Gamma-Butyrolactone SCHEMBL576473 0.88 CYP19A1 (0.44) CYP19A1DDB1CRBNCTRB1CTRC
Alpha-Phenyl-Gamma-Butyrolactone SCHEMBL7909086 0.88 CYP19A1 (0.44) CYP19A1DDB1CRBNCTRB1CTRC
SCHEMBL30485891 0.81 TP53 (0.40) TP53CYP19A1SMN1; SMN2KMT2A
SCHEMBL15786537 0.81 LMNA (0.38) TP53CYP19A1GAATSHRKMT2A
SCHEMBL576597 0.81 CYP19A1 (0.43) CYP19A1KMT2A
SCHEMBL29851186 0.80 CTRC (0.45) TP53CYP19A1GAACTRB1CTRC
Alpha-Phenyl-Gamma-Butyrolactone SCHEMBL28579210 0.80 CYP19A1 (0.40) CYP19A1DDB1CRBNCTRB1CTRC
SCHEMBL11864121 0.78 LMNA (0.38) SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119606006-A Peanut skin procyanidine microcapsule, and preparation method and application thereof 山东省花生研究所 2025-03-14 CN disclosed
CN-115911573-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2023-04-04 CN disclosed
US-11616253-B2 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2023-03-28 US disclosed
US-11367899-B2 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2022-06-21 US disclosed
WO-2022088097-A1 QUANTUM DOT MATERIAL AND RELATED APPLICATION 京东方科技集团股份有限公司 2022-05-05 WO disclosed
CN-109232149-B Synthetic method of alpha-fluoro-alpha-substituted ketone with fluorine-containing quaternary carbon central structure 兰州大学 2021-04-02 CN disclosed
CN-106848406-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery 三菱化学株式会社 2020-09-11 CN disclosed
CN-105633345-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-01-17 CN disclosed
US-10468720-B2 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-11-05 US disclosed
US-20190288338-A1 NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-09-19 US disclosed
US-20100119956-A1 NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2010-05-13 US disclosed
EP-2144321-A1 NONAQUEOUS ELECTROLYTE FOR RECHARGEABLE BATTERY, AND RECHARGEABLE BATTERY WITH NONAQUEOUS ELECTROLYTE Mitsubishi Chemical Corporation (JP) 2010-01-13 EP disclosed
EP-1892789-A1 LITHIUM SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2008-02-27 EP disclosed
US-7132092-B2 Metallized mesoporous silicate and method of oxidation with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-11-07 US disclosed
US-20050090688-A1 Metallized mesoporous silicate and method of oxidation with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-04-28 US disclosed
EP-1473275-A1 METALLIZED MESOPOROUS SILICATE AND METHOD OF OXIDATION WITH THE SAME Sumitomo Chemical Company, Limited (JP) 2004-11-03 EP disclosed
EP-0294220-B1 Photopolymerizable composition HITACHI CHEMICAL CO LTD (JP) 1994-05-25 EP disclosed
US-5034429-A An unsaturated monomer, a photoinitiator and a benzene derivative for providing a cured film HITACHI CHEMICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0294220-A2 Photopolymerizable composition Hitachi Chemical Co., Ltd. (JP) 1988-12-07 EP disclosed
US-3963757-A Process for the preparation of lactones PHILLIPS PETROLEUM COMPANY (US) 1976-06-15 US disclosed