SCHEMBL23926200

SCHEMBL23926200

CCCC(O)CCCOC(=O)CC(=O)OCCCC(O)CCC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.43
NAAA Q02083 1/20 0.42
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 0.39
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DGKA P23743 1/20 0.38
NFKB1 P19838 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
RAD52 P43351 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL22028549 0.89 DGKA (0.47) NAAAFFAR4FFAR1ALDH1A1L3MBTL1
SCHEMBL19817389 0.87 DGKA (0.55) FFAR4FFAR1ALDH1A1L3MBTL1DGKA
SCHEMBL19814989 0.83 HTR2C (0.49) NAAAFFAR4FFAR1ALDH1A1L3MBTL1
SCHEMBL14714687 0.81 DGKA (0.53) NAAAFFAR4FFAR1ALDH1A1L3MBTL1
SCHEMBL30610006 0.81 NAAA (0.62) FAAHNAAAFFAR4FFAR1ALDH1A1
SCHEMBL9406927 0.81 DGKA (0.52) NAAAFFAR4FFAR1ALDH1A1L3MBTL1
SCHEMBL4528593 0.80 TSHR (0.61) FFAR4FFAR1ALDH1A1NFKB1GPR84
SCHEMBL28801074 0.80 DGKA (0.52) NAAAFFAR4FFAR1ALDH1A1L3MBTL1
SCHEMBL29290002 0.79 DGKA (0.50) NAAAFFAR4FFAR1ALDH1A1DGKA
SCHEMBL20772828 0.79 DGKA (0.55) NAAAFFAR4FFAR1ALDH1A1L3MBTL1

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
US-11155675-B2 Method of regioselective synthesis of polyesters from asymmetric diols VERSALIS S.P.A. (IT) 2021-10-26 US disclosed
CN-109689727-B Process for the regioselective synthesis of polyesters from asymmetric diols 维尔萨利斯股份公司 2020-12-01 CN disclosed