SCHEMBL13635219

SCHEMBL13635219

CCCC(CC(C)=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CHRM1 P11229 1/20 0.36
AKR1A1 P14550 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
NFKB1 P19838 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MMP12 P39900 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33

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
SCHEMBL14066244 0.85 ZDHHC7 (0.43) CA1ZDHHC7ENPP2
SCHEMBL7668396 0.82 ALDH1A1 (0.39) TDP1ALDH1A1MMP12MGAMGAA
SCHEMBL141330 0.82 MMP12 (0.49) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL10110046 0.81
SCHEMBL10110049 0.81
SCHEMBL10110030 0.81
SCHEMBL8063540 0.80 TSHR (0.39) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL29008705 0.80 ALDH1A1 (0.37) TDP1ALDH1A1MMP12MGAMGAA
SCHEMBL27389482 0.79
SCHEMBL27389490 0.78 PLA2G2C (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240218119-A1 MODIFIED POLYHYDROXYALKANOATES AND METHODS OF MAKING THEREOF TERRAVERDAE BIOWORKS INC. (CA) 2024-07-04 US disclosed
US-20140329974-A1 BIOPLASTIC COMPOSITION LG HAUSYS, LTD. (KR) 2014-11-06 US disclosed
EP-1253474-B1 Toner containing a polyhydroxyalkanoate binder resin, and image-forming method and image-forming apparatus which make use of the toner CANON KK (JP) 2009-11-18 EP disclosed
US-7265188-B2 Biodegradable polyester blend compositions and methods of making the same THE PROCTER & GAMBLE COMPANY (US) 2007-09-04 US disclosed
US-7166343-B2 Method of and items for reducing latex exposure THE PROCTER & GAMBLE COMPANY (US) 2007-01-23 US disclosed