SCHEMBL5489987

SCHEMBL5489987

CCCCC(CC)COC(=O)OC(=O)OCC(CC)CCCC

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.66
TSHR P16473 3/20 0.66
TDP1 Q9NUW8 2/20 0.66
ATM Q13315 1/20 0.66
ALDH1A1 P00352 6/20 0.57
CA2 P00918 5/20 0.57
RECQL P46063 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 3/20 0.51
MAPK1 P28482 3/20 0.50
HSD17B10 Q99714 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP14 P50281 1/20 0.44
CA1 P00915 2/20 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
SCHEMBL11770377 0.95 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL94797 0.92 CYP3A4 (0.70) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL27885789 0.91 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
Hydrogen Peroxide SCHEMBL28532747 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Water SCHEMBL6315641 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL27624666 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL30101898 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Ammonia Solution, Strong SCHEMBL9998237 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL973798 0.90 CYP3A4 (0.55) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL7721843 0.90 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119529164-A Thermoplastic acrylic resin slurry for in-situ pultrusion with stable and rapid reaction and preparation method and application thereof 重庆国际复合材料股份有限公司 2025-02-28 CN claimed
EP-3666755-A1 ONLINE FULL CONTINUOUS FLOW PRODUCTION PROCESS FOR DIRECTLY PREPARING ORGANIC PEROXIDE WITH HYDROGEN PEROXIDE AS RAW MATERIAL Shanghai Hybrid-Chem Technologies (CN) 2020-06-17 EP claimed
US-8574771-B2 Rechargeable lithium battery SAMSUNG SDI CO., LTD. (KR) 2013-11-05 US claimed
US-20070154810-A1 Rechargeable lithium battery SAMSUNG SDI CO., LTD. (KR) 2007-07-05 US claimed
US-3985720-A Polymerization of ethylenically unsaturated monomer employing a catalyst system comprising dialkylpyrocarbonate, organic acid anhydride, alkaline reagent and H2 O2 PPG INDUSTRIES, INC. (US) 1976-10-12 US claimed
CN-119751727-A Ethylene-vinyl alcohol copolymer resin composition and preparation method and application thereof 万华化学集团股份有限公司 2025-04-04 CN disclosed
CN-109124826-B Ophthalmic lens 爱博诺德(北京)医疗科技股份有限公司 2025-01-10 CN disclosed
CN-115195217-B Transparent laminated board based on glued membrane 卡里福热师私人有限公司 2024-07-30 CN disclosed
CN-109321157-B Adhesive composition for optical film, adhesive layer for optical film, optical film with adhesive layer, and image display device 日东电工株式会社 2024-03-12 CN disclosed
CN-116925281-A Ophthalmic material and method for producing the same 爱博诺德(北京)医疗科技股份有限公司 2023-10-24 CN disclosed
WO-2023198148-A1 WATERBORNE CORE-SHELL EMULSION FOR WOOD SUBSTRATE GUANGDONG HUARUN PAINTS CO., LTD. (CN) 2023-10-19 WO disclosed
US-11739233-B2 Aqueous dispersion of polymeric particles having core-shell structure, the preparation thereof and the coating formed therefrom GUANGDONG HUARUN PAINTS CO., LTD. (CN) 2023-08-29 US disclosed
US-5246630-A Allyl carbonate polyurethanes and photochromic compounds for optical lenses PPG INDUSTRIES, INC. (US) 1993-09-21 US disclosed
EP-0471019-B1 POLYOL(ALLYL CARBONATE) COMPOSITION PPG INDUSTRIES, INC. (US) 1993-08-04 EP disclosed
US-5221721-A Triphenyl phosphite added to a mixture of a poly(allyl carbonate compound, an unsaturated polyurethane and an organic pyrocarbonate; optical lenses; discoloration inhibition; heat resistance PPG INDUSTRIES, INC. (US) 1993-06-22 US disclosed
EP-0471019-A1 POLYOL(ALLYL CARBONATE) COMPOSITION. PPG INDUSTRIES INC (US) 1992-02-19 EP disclosed
US-5084529-A Diethylene glycol bis allyl carbonate, ethylenic unsaturated aliphatic urethane and possible allyl acrylates and dialkyl pyrocarbonates, for lenses PPG INDUSTRIES, INC. (US) 1992-01-28 US disclosed
WO-1990013580-A1 POLYOL(ALLYL CARBONATE) COMPOSITION PPG INDUSTRIES, INC. (US) 1990-11-15 WO disclosed
US-3985720-A Polymerization of ethylenically unsaturated monomer employing a catalyst system comprising dialkylpyrocarbonate, organic acid anhydride, alkaline reagent and H2 O2 PPG INDUSTRIES, INC. (US) 1976-10-12 US disclosed
US-3984386-A Polymerization of ethylenically unsaturated monomer with dialkyl pyrocarbonate and hydrogen peroxide PPG INDUSTRIES, INC. (US) 1976-10-05 US disclosed