SCHEMBL5164573

SCHEMBL5164573

CCCC(CCO)(CCO)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.33
FFAR3 O14843 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
FDPS P14324 2/20 0.31
ARG1 P05089 1/20 0.31
ARG2 P78540 1/20 0.31
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL11416841 0.91 CYP4F2 (0.43) CYP4F2CYP4A11ALDH1A1MEN1KMT2A
SCHEMBL28646108 0.91
SCHEMBL2448745 0.89 FFAR3 (0.38) KDM4CFFAR3HDAC3HDAC1HDAC2
SCHEMBL29025723 0.87 KDM4C (0.37) KDM4CFFAR3HDAC3HDAC1HDAC2
SCHEMBL9179083 0.87 KDM4C (0.37) KDM4CFFAR3HDAC3HDAC1HDAC2
SCHEMBL5163591 0.87 ARG2 (0.35) ALDH1A1ARG1ARG2
SCHEMBL26679414 0.86 CYP4F2 (0.46) CYP4F2CYP4A11ALDH1A1MEN1KMT2A
SCHEMBL5162778 0.86 CYP4F2 (0.46) CYP4F2CYP4A11ALDH1A1MEN1KMT2A
SCHEMBL11415097 0.86 ALDH1A1 (0.38) CYP4F2CYP4A11ALDH1A1MEN1KMT2A
Acetic Acid SCHEMBL8710068 0.84 FFAR3 (0.39) FFAR3ALDH1A1ARG1ARG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1582548-B1 PROCESS FOR PRODUCING POLYMERIZABLE POLYBRANCHED POLYESTER DAINIPPON INK & CHEMICALS (JP) 2007-03-28 EP disclosed
US-4216260-A WATER SOLUBLE SALT OF POLYESTER CONTAINING CARBOXY-SUBSTITUTED DIOL Calloway Chemical Company (US) 1980-08-05 US disclosed