SCHEMBL3623274

SCHEMBL3623274

O=C(O)CCCCc1ccccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.59
MAPT P10636 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
IAPP P10997 1/20 0.54
F13A1 P00488 3/20 0.53
MGLL Q99685 1/20 0.53
HDAC3 O15379 2/20 0.52
HDAC4 P56524 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC7 Q8WUI4 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC10 Q969S8 2/20 0.52
HDAC11 Q96DB2 2/20 0.52
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC9 Q9UKV0 2/20 0.52
HDAC5 Q9UQL6 2/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
SLC6A3 Q01959 1/20 0.52

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
SCHEMBL2517305 0.98 MAPT (0.61) AKR1B1MAPTRXFP1IAPPF13A1
SCHEMBL8009468 0.98 MAPT (0.61) AKR1B1MAPTRXFP1IAPPF13A1
SCHEMBL17078356 0.98 MAPT (0.61) AKR1B1MAPTRXFP1IAPPF13A1
SCHEMBL17078364 0.98 MAPT (0.61) AKR1B1MAPTRXFP1IAPPF13A1
SCHEMBL16230472 0.98 MAPT (0.61) AKR1B1MAPTRXFP1IAPPF13A1
SCHEMBL1827150 0.94 AKR1B1 (0.61) AKR1B1MAPTRXFP1IAPPF13A1
Dodecanoate SCHEMBL10620507 0.90 CYSLTR2 (0.62) MAPTBIDBCL2L1MCL1BAK1
Stearic Acid SCHEMBL2885455 0.90 CYSLTR2 (0.62) MAPTBIDBCL2L1MCL1BAK1
SCHEMBL22826566 0.88 MAPT (0.67) MAPTRXFP1F13A1HDAC3HDAC4
Dodecanoate SCHEMBL27671805 0.87 CYSLTR2 (0.59) MAPTBIDBCL2L1MCL1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188375-A1 MUTANT OF PROPIONYL-COA TRANSFERASE FROM CLOSTRIDIUM PROPIONICUM AND PREPARING METHOD FOR PLA OR PLA COPOLYMER USING THE SAME LG Chem. Ltd. (KR) 2010-05-26 EP claimed
WO-2009022797-A1 MUTANT OF PROPIONYL-COA TRANSFERASE FROM CLOSTRIDIUM PROPIONICUM AND PREPARING METHOD FOR PLA OR PLA COPOLYMER USING THE SAME LG CHEM, LTD. (KR) 2009-02-19 WO claimed
CN-115725231-A Water-based composition for barrier and laminate 荒川化学工业株式会社 2023-03-03 CN disclosed
CN-114774053-A Adhesive compositions and methods 沙特阿美技术公司 2022-07-22 CN disclosed
CN-110791246-B Adhesive composition and method 沙特阿美技术公司 2022-04-22 CN disclosed
CN-112979938-A Aliphatic polycarbonates for polyurethanes 沙特阿美技术公司 2021-06-18 CN disclosed
CN-112930376-A Combination of water-based primer composition and ink, and printed matter 阪田油墨股份有限公司 2021-06-08 CN disclosed
CN-106661215-B Aliphatic polycarbonate polyol composition 沙特阿美技术公司 2020-09-22 CN disclosed
CN-110791246-A Adhesive composition and method 沙特阿美技术公司 2020-02-14 CN disclosed
US-20070224689-A1 Method for predicting or identifying the onset of premature membrane rupture during pregnancy KIMBERLY-CLARK WORLDWIDE, INC. (US) 2007-09-27 US disclosed
EP-0707210-B1 Agent and method for determination of ammonium ions MERCK PATENT GMBH (DE) 2003-12-17 EP disclosed
WO-1996040832-A1 THERMOSET COATING COMPOSITIONS HAVING IMPROVED HARDNESS AND CURING PROPERTIES EXXON CHEMICAL PATENTS INC. (US) 1996-12-19 WO disclosed
WO-1996033229-A1 COMPOSITIONS CONTAINING POLYOLS, PHENOLIC ESTERS AND ISOCYANATES EXXON CHEMICAL COMPANY (US) 1996-10-24 WO disclosed
WO-1996033245-A1 THERMOSET COATING COMPOSITIONS HAVING IMPROVED HARDNESS EXXON CHEMICAL PATENTS INC. (US) 1996-10-24 WO disclosed
EP-0707210-A1 Agent and method for determination of ammonium ions MERCK PATENT GmbH (DE) 1996-04-17 EP disclosed
US-5008285-A Antiarthritic agent with low gastric irritability side effect HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1991-04-16 US disclosed
EP-0159684-B1 (6,11-DIHYDRO-11-OXODIBENZ(B,E)OXEPINYL)PENTANOIC ACIDS AND DERIVATIVES, A PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-27 EP disclosed
EP-0154775-B1 WATER DISPERSABLE BINDER AGENTS BASED ON MODIFIED EPOXY-AMINE ADDUCTS, THEIR PREPARATION AND APPLICATION BASF Lacke + Farben AG (DE) 1989-09-20 EP disclosed
EP-0159684-A2 (6,11-Dihydro-11-oxodibenz(b,e)oxepinyl)pentanoic acids and derivatives, a process and intermediates for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1985-10-30 EP disclosed
US-4308185-A WHEREIN THE EPOXY RESIN IS GRAFT POLYMERIZED TO FORM AN ADDITION-CONDENSATION COPOLYMER THAT IS IONIZABLE AND DISPERSABLE SCM CORPORATION (US) 1981-12-29 US disclosed