Acetic Acid Butyl Ester

Acetic Acid Butyl Ester

SCHEMBL451540

CCCCOC(C)=O.Cc1ccc(C)cc1

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.72
TSHR P16473 5/20 0.52
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 5/20 0.50
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
ESR1 P03372 2/20 0.49
MAPK1 P28482 2/20 0.49
CYP2D6 P10635 1/20 0.49
NR1H2 P55055 1/20 0.49
RNASEL Q05823 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 1/20 0.47
PDE4D Q08499 1/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 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
Acetic Acid Butyl Ester SCHEMBL1527432 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL8056744 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL9336718 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL11076273 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL9418066 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL3182016 1.00 ALDH1A1 (0.72) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Pentyl Ester SCHEMBL7772491 0.94 ALDH1A1 (0.63) ALDH1A1TSHRTDP1L3MBTL1LMNA
Hexyl Acetate SCHEMBL8084256 0.92 ALDH1A1 (0.61) ALDH1A1TSHRL3MBTL1LMNAESR1
Acetic Acid Butyl Ester SCHEMBL20540736 0.91 ALDH1A1 (0.64) ALDH1A1TSHRTDP1L3MBTL1LMNA
Acetic Acid Butyl Ester SCHEMBL9577010 0.91 ALDH1A1 (0.64) ALDH1A1TSHRTDP1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111572130-B Impact-resistant composite material, preparation method and application thereof 烟台恒诺新材料有限公司 2024-04-02 CN claimed
CN-115651456-A Coating formula with function of preventing algae from breeding 上海涂固安高科技有限公司 2023-01-31 CN claimed
US-5650461-A CHEMICAL RESISTANT COATINGS OF MULTILAYER PAINTS, EXTENDERS, PIGMENTS, BINDERS AND SOLVENTS STATE OF ISRAEL-MINISTRY OF DEFENCE, ARMAMENT DEVELOPMENT AUTHORITY, RAFAEL (IL) 1997-07-22 US claimed
US-11987557-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof TRIOPTOTEC GMBH (DE) 2024-05-21 US disclosed
CN-111572130-B Impact-resistant composite material, preparation method and application thereof 烟台恒诺新材料有限公司 2024-04-02 CN disclosed
CN-117545794-A Functionalized Q-D/T-siloxane-based polymer materials and formulations and methods of making the same 硅氧烷有限公司 2024-02-09 CN disclosed
WO-2024002117-A1 ANTIBACTERIAL FLUORINE-MODIFIED EPOXY VINYL ESTER RESIN, METHOD FOR PREPARING SAME, AND MULTI-MECHANISM SYNERGISTIC UNIVERSAL ANTI-CORROSION COATING 海洋化工研究院有限公司 2024-01-04 WO disclosed
WO-2023247716-A2 BISMUTH-CONTAINING CATALYST COMPRISING A DICARBOXYLATE LIGAND BASF SE (DE) 2023-12-28 WO disclosed
US-11807709-B2 Method for producing polyisocyanates of (cyclo)aliphatic diisocyanates which are flocculation-stable in solvents BASF SE 2023-11-07 US disclosed
EP-3526268-B1 COATING AGENT SYSTEM BASED ON SALTS OF AN ALIPHATIC MONOCARBOXYLIC ACID BASF COATINGS GMBH (DE) 2023-09-20 EP disclosed
EP-3490724-B1 POLYURETHANE COATING COMPOSITIONS CONTAINING 1,1-DI-ACTIVATED VINYL COMPOUNDS AND RELATED COATINGS AND PROCESSES PPG IND OHIO INC (US) 2023-09-20 EP disclosed
US-4481315-A LACQUERS CIBA-GEIGY CORPORATION (US) 1984-11-06 US disclosed
US-4461870-A High solid coating composition containing novel microparticles of crosslinked copolymer including amphoionic groups NIPPON PAINT CO., LTD. (JP) 1984-07-24 US disclosed
US-4391858-A Coating process GLASURIT AMERICA, INC. (US) 1983-07-05 US disclosed
EP-0080840-A1 A process for the production of a multilayer protective and/or decorative coating upon a surface of a substrate GLASURIT AMERICA, INC. (US) 1983-06-08 EP disclosed
US-4315053-A Base coats covered by a clear lacquer coating and process for coating BASF FARBEN & FASERN AG (DE) 1982-02-09 US disclosed
US-4289686-A FOR LACQUERS CIBA-GEIGY CORPORATION (US) 1981-09-15 US disclosed
US-4232077-A Hot-stamping film, and process and apparatus for its manufacture MEISEL FRITZ 1980-11-04 US disclosed
US-4113705-A Triisocyanates useful for the production of polyurethane resins BAYER AKTIENGESELLSCHAFT (DE) 1978-09-12 US disclosed
US-4045462-A POLYURETHANES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11987557-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof PYCR1, CRY1, PPOX ALDH1A1 250/4885TSHR 4876/4885TDP1 886/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.