SCHEMBL477348

SCHEMBL477348

CCCCC(O)c1ccccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
PPARG P37231 2/20 0.40
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.38
ACP3 P15309 1/20 0.37
CSNK1E P49674 1/20 0.37
CNR2 P34972 1/20 0.37
TP53 P04637 1/20 0.36
CYP3A4 P08684 2/20 0.36
POLB P06746 1/20 0.36
CA2 P00918 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL9796192 0.94 PPARG (0.46) ESR1ALDH1A1KDM4EPPARGGAA
SCHEMBL9795914 0.92 PPARG (0.48) ESR1ALDH1A1PPARGCSNK1ETP53
SCHEMBL3936218 0.92 PPARG (0.48) ESR1ALDH1A1PPARGCSNK1ETP53
SCHEMBL539922 0.90 ESR1 (0.43) ESR1PPARGGAALMNAACP3
SCHEMBL8216569 0.87 ALDH1A1 (0.46) ALDH1A1KDM4EPPARGLMNACSNK1E
SCHEMBL6055391 0.85 PPARG (0.38) ALDH1A1KDM4EPPARGCNR2TP53
SCHEMBL23347610 0.85 CSNK1E (0.41) ESR1ALDH1A1KDM4EPPARGGAA
SCHEMBL30949077 0.82 ESR1 (0.41) ESR1KDM4EPPARGGAAACP3
SCHEMBL30949071 0.82 ESR1 (0.41) ESR1KDM4EPPARGGAAACP3
SCHEMBL5265776 0.82 ESR1 (0.43) ESR1ALDH1A1KDM4EGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0096641-A2 Process for preparing pyrylium salts EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1983-12-21 EP claimed
US-20230174786-A1 METHOD FOR THE PRODUCTION OF FREE-FLOWING GRANULES OMYA INTERNATIONAL AG (CH) 2023-06-08 US disclosed
CN-115836061-A Odorants and compositions comprising odorants 丝趣科尔卡有限公司 2023-03-21 CN disclosed
CN-115803309-A Odorous compounds and methods of making the same 丝趣科尔卡有限公司 2023-03-14 CN disclosed
CN-115551829-A Odorants and compositions comprising odorants 丝趣科尔卡有限公司 2022-12-30 CN disclosed
CN-110494413-B Compounds for reducing perception of malodour and uses thereof 凯姆克姆公司 2022-11-22 CN disclosed
CN-115003662-A Odorants and compositions comprising odorants 丝趣科尔卡有限公司 2022-09-02 CN disclosed
CN-112334567-A Odorant secondary alcohols and compositions thereof 丝趣科尔卡有限公司 2021-02-05 CN disclosed
CN-111770980-A Odorous acetals of ethyl vanillin and ethyl vanillin derivatives 丝趣科尔卡有限公司 2020-10-13 CN disclosed
CN-111133086-A Compositions comprising odorants 丝趣科尔卡有限公司 2020-05-08 CN disclosed
EP-2412694-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALCOHOL Mitsui Chemicals, Inc. (JP) 2012-02-01 EP disclosed
EP-1300381-B1 Process for preparing optically active alcohols JAPAN SCIENCE & TECH AGENCY (JP) 2006-03-08 EP disclosed
US-6887820-B1 For producing optically active secondary alcohols, producing optically active compounds useful for various utilities such as intermediates for synthesizing pharmaceutical agents, liquid crystal materials and agents for optical resolution JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2005-05-03 US disclosed
EP-1300381-A1 Process for preparing optically active alcohols Japan Science and Technology Corporation (JP) 2003-04-09 EP disclosed
US-20020016269-A1 Particle perfume delivery system THE PROCTER & GAMBLE CO. 2002-02-07 US disclosed
US-6184381-B1 USEFUL AS INTERMEDIATES FOR SYNTHESIZING PHARMACEUTICAL CHEMICALS, LIQUID CRYSTAL MATERIALS AND AGENTS FOR OPTICAL RESOLUTION, REDUCTION, KETONES TO ALCOHOL, IMINES TO AMINES JAPAN SCIENCE & TECHNOLOGY CORP. (JP) 2001-02-06 US disclosed
EP-0916637-A1 PROCESS FOR PREPARATING OPTICALLY ACTIVE COMPOUNDS Japan Science and Technology Corporation (JP) 1999-05-19 EP disclosed
US-5006534-A Substituted ethers, thioethers and amines for use as lipoxygenase inhibitors BAYER AKTIENGESELLSCHAFT (DE) 1991-04-09 US disclosed
EP-0224086-B1 SUBSTITUTED BENZYL ETHERS BAYER AG (DE) 1990-10-24 EP disclosed
EP-0224086-A2 Substituted benzyl ethers BAYER AG (DE) 1987-06-03 EP disclosed