Acetic Acid Propyl Ester

Acetic Acid Propyl Ester

SCHEMBL356156

CCCOC(C)=O.COCCO

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
TSHR P16473 3/20 0.45
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
CHRM1 P11229 3/20 0.40
CHRM5 P08912 2/20 0.40
CHRM3 P20309 2/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
HTR1A P08908 1/20 0.40
CHRNB2 P17787 1/20 0.40
TBXA2R P21731 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRNA10 Q9GZZ6 1/20 0.40
CHRNA9 Q9UGM1 1/20 0.40

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
2-Methoxyethanol SCHEMBL5682074 0.89 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Butyl Ester SCHEMBL15021138 0.88 ALDH1A1 (0.72) ALDH1A1TSHRLMNAHSD17B10ACHE
2-Methoxyethanol SCHEMBL6926848 0.86 ALDH1A1 (0.48) ALDH1A1TSHRLMNAHSD17B10CHRM1
2-Methoxyethanol SCHEMBL11020645 0.86 ALDH1A1 (0.48) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL3273915 0.86 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL499076 0.86 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL1258002 0.86 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Pentyl Ester SCHEMBL2917892 0.86 ALDH1A1 (0.63) ALDH1A1TSHRACHEHCAR2
2-Methoxyethanol SCHEMBL2382470 0.84 ALDH1A1 (0.54) ALDH1A1TSHRLMNAHSD17B10CHRM1
Ethyl Acetate SCHEMBL110240 0.84 ALDH1A1 (0.64) ALDH1A1TSHRLMNAHSD17B10CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080083148-A1 Novelty gel pad and gel picture frame UANG YUH-JYE 2008-04-10 US claimed
US-12031079-B2 Polymerisable LC medium and polymer film with flat optical dispersion MERCK PATENT GMBH (DE) 2024-07-09 US disclosed
US-20240209264-A1 POLYMERISABLE OLIGOMERIC LIQUID CRYSTAL, POLYMERISABLE MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-06-27 US disclosed
EP-4382585-A1 POLYMERISABLE OLIGOMERIC LIQUID CRYSTAL, POLYMERISABLE MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM Merck Patent GmbH (DE) 2024-06-12 EP disclosed
EP-3837334-B1 POLYMERIZABLE LIQUID CRYSTAL MATERIAL AND POLYMERIZED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-04-03 EP disclosed
WO-2024061796-A1 POLYMERISABLE LIQUID CRYSTAL MEDIUM AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-03-28 WO disclosed
EP-3837333-B1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-03-27 EP disclosed
US-11939510-B2 Polymerisable liquid crystal material and polymerised liquid crystal film MERCK PATENT GMBH (DE) 2024-03-26 US disclosed
WO-2024052363-A1 POLYMERIZABLE LIQUID CRYSTAL MATERIAL AND POLYMERIZED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2024-03-14 WO disclosed
EP-4334408-A1 REACTIVE MESOGENS Merck Patent GmbH (DE) 2024-03-13 EP disclosed
EP-1386904-A1 Acenaphthylene derivative, polymer, and antireflection film-forming composition JSR Corporation (JP) 2004-02-04 EP disclosed
EP-1345646-A2 MICRONEEDLE DEVICES AND PRODUCTION THEREOF Georgia Tech Research Corporation (US) 2003-09-24 EP disclosed
EP-0810996-B1 IMIDAZOLIDINONE DERIVATIVES AS CORROSION INHIBITORS HE ZHIQIANG ALEX (US) 2002-10-09 EP disclosed
WO-2001021285-A9 POROUS FILTER ELEMENT AND METHOD OF FABRICATION THEREOF ISIS INNOVATION (GB) 2002-09-06 WO disclosed
WO-2002064193-A2 MICRONEEDLE DEVICES AND PRODUCTION THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2002-08-22 WO disclosed
US-20020082543-A1 Microneedle devices and production thereof GEORGIA TECH RESEARCH CORPORATION 2002-06-27 US disclosed
EP-1214614-A1 PHOTONIC CRYSTAL MATERIALS ISIS INNOVATION LIMITED (GB) 2002-06-19 EP disclosed
EP-1214135-A1 POROUS FILTER ELEMENT AND METHOD OF FABRICATION THEREOF ISIS INNOVATION LIMITED (GB) 2002-06-19 EP disclosed
WO-2001022133-A1 PHOTONIC CRYSTAL MATERIALS ISIS INNOVATION LIMITED (GB) 2001-03-29 WO disclosed
WO-2001021285-A1 POROUS FILTER ELEMENT AND METHOD OF FABRICATION THEREOF ISIS INNOVATION LIMITED (GB) 2001-03-29 WO disclosed