Acetic Acid Propyl Ester

Acetic Acid Propyl Ester

SCHEMBL1258002

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nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
TSHR P16473 2/20 0.52
LMNA P02545 2/20 0.50
HSD17B10 Q99714 1/20 0.50
CHRM1 P11229 3/20 0.46
CHRM5 P08912 2/20 0.46
CHRM3 P20309 2/20 0.46
PGR P06401 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
HTR1A P08908 1/20 0.46
CHRNB2 P17787 1/20 0.46
TBXA2R P21731 1/20 0.46
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA7 P36544 1/20 0.46
CHRNA4 P43681 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRNA10 Q9GZZ6 1/20 0.46
CHRNA9 Q9UGM1 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 Propyl Ester SCHEMBL499076 1.00 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL3273915 0.95 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL468203 0.92 ALDH1A1 (0.64) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL14991 0.92
Acetic Acid Propyl Ester SCHEMBL23495512 0.92 ALDH1A1 (0.70) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Butyl Ester SCHEMBL10478407 0.91 ALDH1A1 (0.78) ALDH1A1TSHRLMNAHSD17B10HCAR2
Acetic Acid Propyl Ester SCHEMBL4627949 0.90 ALDH1A1 (0.62) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL2354525 0.90 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL27827816 0.90 ALDH1A1 (0.61) ALDH1A1TSHRLMNAHSD17B10CHRM1
Acetic Acid Propyl Ester SCHEMBL18229929 0.89

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-9834691-B2 Hyperbranched polyesters in printing inks BASF SE (DE) 2017-12-05 US disclosed
US-20140193619-A1 HYPERBRANCHED POLYESTERS IN PRINTING INKS BASF SE 2014-07-10 US disclosed
US-20140065385-A1 HYPERBRANCHED POLYESTERS IN PRINTING INKS BASF SE 2014-03-06 US disclosed
EP-2697316-A1 HYPERBRANCHED POLYESTERS IN PRINTING INKS BASF SE (DE) 2014-02-19 EP disclosed
WO-2012140202-A1 HYPERBRANCHED POLYESTERS IN PRINTING INKS BASF SE (DE) 2012-10-18 WO disclosed
US-7887903-B2 An outer layer having a printed portion on a surface and an inner layer having an antifogging agent; polyurethane being the solid content of the printed portion; antifog surfactants on interior layer; no visible moisture condensed on inside of food- wrapped trays on display; storagestability on coils KUREHA CORPORATION (JP) 2011-02-15 US disclosed
US-20070212549-A1 Antifog Laminated Film KUREHA CORPORATION (JP) 2007-09-13 US disclosed
EP-1745924-A1 ANTIFOGGING LAMINATED FILM Kureha Corporation (JP) 2007-01-24 EP disclosed