SCHEMBL7072928

SCHEMBL7072928

C=COC(=O)C(CC)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
CYP2C19 P33261 1/20 0.49
LMNA P02545 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.46
MAPT P10636 2/20 0.46
HTT P42858 1/20 0.46
POLB P06746 2/20 0.45
TDP1 Q9NUW8 3/20 0.45
RECQL P46063 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL7713499 1.00 KDM4E (0.49) KDM4EGAACYP2C19LMNAHSD17B10
Acetic Acid SCHEMBL27542077 0.97 KDM4E (0.47) KDM4EGAACYP2C19LMNAHSD17B10
Acetic Acid SCHEMBL27542062 0.97 KDM4E (0.47) KDM4EGAACYP2C19LMNAHSD17B10
Acetic Acid SCHEMBL27432920 0.97 KDM4E (0.47) KDM4EGAACYP2C19LMNAHSD17B10
SCHEMBL8076939 0.88 LMNA (0.44) KDM4EGAALMNAHSD17B10MAPT
SCHEMBL8066959 0.85 ALDH1A1 (0.43) KDM4EGAACYP2C19LMNAMEN1
SCHEMBL25318352 0.85 GAA (0.50) KDM4EGAALMNAHSD17B10MEN1
SCHEMBL25246324 0.85 CYP2C19 (0.50) KDM4ECYP2C19LMNAMEN1KMT2A
SCHEMBL8080089 0.84 L3MBTL1 (0.43) CYP2C19LMNAMEN1KMT2AL3MBTL1
SCHEMBL27432922 0.83 CYP2C19 (0.53) KDM4EGAACYP2C19LMNAHSD17B10

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894814-A Novel polycarboxylic acid slump retaining agent and preparation method thereof 科之杰新材料集团有限公司 2023-04-04 CN claimed
CN-115838458-A Novel polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2023-03-24 CN claimed
CN-113316744-B Oxime ester photoinitiators with special aroyl chromophores 巴斯夫欧洲公司 2024-07-30 CN disclosed
CN-117483112-A Novel scheelite collector and heating concentration beneficiation process thereof 文山麻栗坡紫金钨业集团有限公司 2024-02-02 CN disclosed
CN-115210219-A Oxime ester photoinitiators 巴斯夫欧洲公司 2022-10-18 CN disclosed
CN-107652222-B Oxime ester photoinitiators 巴斯夫欧洲公司 2021-09-10 CN disclosed
CN-113316744-A Oxime ester photoinitiators with specific aroyl chromophores 巴斯夫欧洲公司 2021-08-27 CN disclosed
CN-101023084-A Compositions containing phthalocyanine dyes CIBA SC HOLDING AG (CH) 2007-08-22 CN disclosed
US-20030003552-A1 Method for kinetic resolution of racemates of alcohols or carboxylic acid esters THEIL FRITZ (DE) 2003-01-02 US disclosed
US-6365398-B1 REACTING RACEMIC CARBOXYLIC ACID ESTER WITH RACEMIC ALCOHOL IN PRESENCE OF A CARBOXYL ESTER HYDROLASE BASF AKTIENGESELLSCHAFT (DE) 2002-04-02 US disclosed
EP-1031629-A2 Method of preparation of stereoisomeric carboxylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2000-08-30 EP disclosed
US-6013411-A PHOTOSENSITIVE COMPOSITION WITH HOMO OR COPOLYCARBONS, HALOGENIUM COMPOUNDS AND SULFONIUM COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2000-01-11 US disclosed
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
EP-0907666-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-14 EP disclosed
WO-1997049736-A2 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed
EP-0031637-B1 IMPROVEMENTS IN OR RELATING TO FILLED POLYMERIC COMPOSITIONS, HYDRATED ALUMINA FILLERS THEREFOR AND PROCESSES FOR THE PRODUCTION THEREOF RAYCHEM LIMITED (GB) 1984-10-03 EP disclosed
US-4294905-A DIAZO COMPOUNDS, OLEOPHILIC AND STORAGE STABLE FUJI PHOTO FILM CO., LTD. (JP) 1981-10-13 US disclosed