Acetic Acid Propyl Ester

Acetic Acid Propyl Ester

SCHEMBL6141124

C=CC.C=CC.CCCOC(C)=O.OCCO

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
TSHR P16473 5/20 0.43
LMNA P02545 2/20 0.41
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
PGR P06401 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
HTR1A P08908 1/20 0.39
CHRNB2 P17787 1/20 0.39
TBXA2R P21731 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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 Propyl Ester SCHEMBL28224496 0.94 ALDH1A1 (0.56) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL20210830 0.93 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL220171 0.93 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL487417 0.93 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL4450845 0.93 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL29279689 0.89 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL3273915 0.89 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10HCAR2
Acetic Acid Butyl Ester SCHEMBL15023860 0.88 ALDH1A1 (0.69) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Butyl Ester SCHEMBL4514617 0.88 ALDH1A1 (0.69) ALDH1A1TSHRLMNAHSD17B10HPGD
Acetic Acid Propyl Ester SCHEMBL143405 0.85 ALDH1A1 (0.44) ALDH1A1TSHRLMNAHSD17B10HPGD

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130295807-A1 SIZING ADDITIVES FOR DRYCLEANING PROCESSES FABRITEC INTERNAT CORP (US) 2013-11-07 US claimed
US-20120329349-A1 SIZING ADDITIVES FOR DRYCLEANING PROCESSES FABRITEC INTERNATIONAL CORPORATION (US) 2012-12-27 US claimed
US-8795543-B2 Sizing additives for drycleaning processes FABRITEC INTERNATIONAL CORPORATION (US) 2014-08-05 US disclosed
US-20130295807-A1 SIZING ADDITIVES FOR DRYCLEANING PROCESSES FABRITEC INTERNAT CORP (US) 2013-11-07 US disclosed
US-8507045-B2 Sizing additives for drycleaning processes FABRITEC INTERNATIONAL CORPORATION (US) 2013-08-13 US disclosed
US-20120329349-A1 SIZING ADDITIVES FOR DRYCLEANING PROCESSES FABRITEC INTERNATIONAL CORPORATION (US) 2012-12-27 US disclosed
EP-1535976-A1 Composition for film formation, method for preparing the composition, and method for forming insulating film JSR Corporation (JP) 2005-06-01 EP disclosed
US-20050112386-A1 Composition for film formation, method for preparing the composition, and method for forming insulating film JSR CORPORATION (JP) 2005-05-26 US disclosed