SCHEMBL7553279

SCHEMBL7553279

CCCC(C)(C)OOOC(=O)CCCCCO

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DGKA P23743 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 5/20 0.34
ALDH1A1 P00352 2/20 0.34
PAM P19021 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
DUSP3 P51452 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CNR2 P34972 1/20 0.33
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9842720 0.89 TSHR (0.35) DGKAMAPTMAPK1LMNAALDH1A1
SCHEMBL15758715 0.88 DGKA (0.36) KDM4EDGKAMAPTMAPK1LMNA
SCHEMBL95496 0.88 DGKA (0.36) KDM4EDGKAMAPTMAPK1LMNA
SCHEMBL6662610 0.87 KDM4E (0.38) CYP4F2CYP4A11KDM4ESMN1; SMN2DGKA
SCHEMBL6659869 0.87 KDM4E (0.38) CYP4F2CYP4A11KDM4ESMN1; SMN2DGKA
SCHEMBL465271 0.87 DGKA (0.36) KDM4EDGKAMAPTMAPK1LMNA
SCHEMBL29525716 0.86 ALDH1A1 (0.35) DGKAMAPTMAPK1LMNAALDH1A1
SCHEMBL22773839 0.83 ALDH1A1 (0.41) LMNAALDH1A1HSD17B10
SCHEMBL6661924 0.82 CYP4F2 (0.40) CYP4F2CYP4A11KDM4ESMN1; SMN2DGKA
SCHEMBL6661053 0.82 TDP1 (0.40) CYP4F2CYP4A11KDM4ESMN1; SMN2DGKA

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-1220837-A1 PROCESS FOR PREPARING PEROXIDES USING MIXED ANHYDRIDES Akzo Nobel N.V. (NL) 2002-07-10 EP disclosed
WO-2001027078-A1 PROCESS FOR PREPARING PEROXIDES USING MIXED ANHYDRIDES AKZO NOBEL N.V. (NL) 2001-04-19 WO disclosed