SCHEMBL79515

SCHEMBL79515

CCCCC(CC)COC(=O)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.76
CYP3A4 P08684 3/20 0.76
CA2 P00918 1/20 0.76
LMNA P02545 4/20 0.71
HSD17B10 Q99714 1/20 0.71
PRSS1 P07477 1/20 0.68
PRSS2 P07478 1/20 0.68
PRSS3 P35030 1/20 0.68
MAPK1 P28482 3/20 0.67
TSHR P16473 3/20 0.67
TDP1 Q9NUW8 3/20 0.54
ATM Q13315 1/20 0.54
ADRB2 P07550 2/20 0.48
ADRB1 P08588 2/20 0.48
ADRB3 P13945 2/20 0.48
MAPT P10636 1/20 0.48
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.46

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
SCHEMBL30825765 1.00 ALDH1A1 (0.76) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL27543081 0.97 ALDH1A1 (0.72) ALDH1A1CYP3A4CA2LMNAHSD17B10
Benzoic Acid SCHEMBL15789975 0.96 ALDH1A1 (0.70) ALDH1A1CYP3A4CA2LMNAHSD17B10
Benzoic Acid SCHEMBL28570741 0.96 ALDH1A1 (0.70) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL30437742 0.95 PRSS1 (0.74) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL15286366 0.94 ALDH1A1 (0.68) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL3320267 0.94 PRSS1 (0.77) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL570998 0.94 ALDH1A1 (0.66) ALDH1A1CYP3A4CA2LMNAHSD17B10
Diethylamine SCHEMBL2939168 0.93 ALDH1A1 (0.67) ALDH1A1CYP3A4CA2LMNAHSD17B10
SCHEMBL110764 0.92 ALDH1A1 (0.81) ALDH1A1CYP3A4CA2LMNAHSD17B10

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

Appears in 2963 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109795-A1 HIGH REFRACTIVE INDEX POLYVINYL ACETAL RESINS MODIFIED WITH CYCLIC ALDEHYDES EASTMAN CHEMICAL COMPANY (US) 2026-04-23 US claimed
EP-4598999-A1 HIGH REFRACTIVE INDEX POLYVINYL ACETAL RESINS MODIFIED WITH CYCLIC ALDEHYDES Eastman Chemical Company (US) 2025-08-13 EP claimed
US-20250197609-A1 ECOFRIENDLY, BIODEGRADABLE BIOLOGICAL POLYSACCHARIDE COMPOSITION FOR PACKAGING MATERIALS BLUE EVOLUTION, INC. (US) 2025-06-19 US claimed
WO-2025128797-A1 ECOFRIENDLY, BIODEGRADABLE BIOLOGICAL POLYSACCHARIDE COMPOSITION FOR PACKAGING MATERIALS BLUE EVOLUTION, INC (US) 2025-06-19 WO claimed
CN-119998391-A High refractive index polyvinyl acetal resins modified with cyclic aldehydes 伊士曼化工公司 2025-05-13 CN claimed
CN-119913356-A Extractant, preparation method and application thereof 浙江大学衢州研究院 2025-05-02 CN claimed
US-20250129006-A1 PRODUCTION OF BENZOIC ACID FROM A BIOMASS SYENSQO SA (BE) 2025-04-24 US claimed
US-12281278-B2 Thermal management fluids with synergistic heat capacity ExxonMobil Technology and Engineering Company (US) 2025-04-22 US claimed
CN-112042275-B Composition and method for producing organic electroluminescent element 三菱化学株式会社 2025-03-28 CN claimed
WO-2024157522-A1 METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT 三菱ケミカル株式会社 2024-08-02 WO claimed
US-20030147838-A1 Cosmetic films OPI PRODUCTS, INC. 2003-08-07 US claimed
US-20030124154-A1 Cosmetic films OPI PRODUCTS, INC. 2003-07-03 US claimed
EP-1242546-A1 FILM FORMING COMPOSITIONS CONTAINING OCTYL BENZOATE VELSICOL CHEMICAL CORPORATION (US) 2002-09-25 EP claimed
WO-2002064712-A1 A METAL WORKING LUBRICANT COMPOSITION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2002-08-22 WO claimed
WO-2001074977-A2 LUBRICANT AND FLUSHING COMPOSITIONS ICI AMERICAS INC. (US) 2001-10-11 WO claimed
WO-2001040412-A1 PETROLEUM FUEL ADDITIVE FORMULATIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2001-06-07 WO claimed
WO-2001029140-A1 FILM FORMING COMPOSITION CONTAINING OCTYL BENZOATE VELSICOL CHEMICAL CORPORATION (US) 2001-04-26 WO claimed
US-4952649-A COORDINATION CATALYSTS USING BOTH AN ELECTRON DONOR AND ESTERS OF POLYCARBOXYLIC ACIDS; STEREOSPECIFIC; DURABILITY MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-08-28 US claimed
US-4080209-A Photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JA) 1978-03-21 US claimed
US-4076924-A CATALYST COMPRISING A TITANIUM COMPONENT AND A GROUP I TO III ORGANO-METAL COMPOUND MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) 1978-02-28 US claimed