SCHEMBL23926229

SCHEMBL23926229

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

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.47
NAAA Q02083 1/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
DGKA P23743 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NFKB1 P19838 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
GPR84 Q9NQS5 4/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EPHX1 P07099 1/20 0.40

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
SCHEMBL9406927 0.89 DGKA (0.52) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL30610006 0.89 NAAA (0.62) FAAHNAAACA1CA2FFAR4
SCHEMBL19815074 0.87 DGKA (0.60) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL20772828 0.87 DGKA (0.55) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL19815182 0.83 HTR2C (0.53) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL17507920 0.83 DGKA (0.50) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL8570716 0.82 KDM4E (0.51) FAAHCA1CA2DGKAMGAM
SCHEMBL9406938 0.82 FFAR4 (0.54) FAAHNAAAFFAR4FFAR1DGKA
SCHEMBL19817302 0.81 DGKA (0.58) NAAAFFAR4FFAR1DGKAALDH1A1
SCHEMBL152233 0.81 ALDH1A1 (0.61) FAAHNAAADGKAALDH1A1MGAM

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