SCHEMBL17870903

SCHEMBL17870903

COC(=O)CCCCCCCCC=CCCCCOC(C)=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.54
EPHX2 P34913 3/20 0.54
PRKCA P17252 1/20 0.48
FAAH O00519 1/20 0.47
TSHR P16473 2/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CNR2 P34972 1/20 0.43
ALOX5 P09917 2/20 0.43
OXER1 Q8TDS5 1/20 0.43
DGKA P23743 1/20 0.42

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
SCHEMBL17870902 1.00 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2PRKCAFAAH
SCHEMBL17870914 1.00 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2PRKCAFAAH
SCHEMBL17870915 1.00 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2PRKCAFAAH
SCHEMBL4306967 0.93 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2PRKCATSHR
SCHEMBL2834472 0.93 ALDH1A1 (0.54) ALDH1A1LMNAEPHX2PRKCATSHR
SCHEMBL3501830 0.89 TSHR (0.56) ALDH1A1LMNATSHRDGKA
SCHEMBL3503952 0.89 TSHR (0.56) ALDH1A1LMNATSHRDGKA
SCHEMBL3502675 0.89 TSHR (0.56) ALDH1A1LMNATSHRDGKA
SCHEMBL9968682 0.89 TSHR (0.56) ALDH1A1LMNATSHRDGKA
SCHEMBL3504472 0.89 TSHR (0.56) ALDH1A1LMNATSHRDGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237372-B1 METHOD FOR PRODUCING OMEGA-HYDROXY FATTY ACID ESTER AND PRECURSOR COMPOUND THEREOF KAO CORP (JP) 2021-01-20 EP disclosed
EP-3237372-A1 METHOD FOR PRODUCING OMEGA-HYDROXY FATTY ACID ESTER AND PRECURSOR COMPOUND THEREOF Kao Corporation (JP) 2017-11-01 EP disclosed
WO-2016103677-A1 METHOD FOR PRODUCING OMEGA-HYDROXY FATTY ACID ESTER AND PRECURSOR COMPOUND THEREOF KAO CORPORATION (JP) 2016-06-30 WO disclosed
WO-2016103677-A1 METHOD FOR PRODUCING OMEGA-HYDROXY FATTY ACID ESTER AND PRECURSOR COMPOUND THEREOF KAO CORPORATION (JP) 2016-06-30 WO disclosed