SCHEMBL28748043

SCHEMBL28748043

CCCCC=C(C)C(=O)OC(O)CO

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
MAPT P10636 3/20 0.34
MAPK1 P28482 2/20 0.34
GRIK1 P39086 1/20 0.34
FAAH O00519 3/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
PRKCA P17252 2/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
DGKA P23743 1/20 0.33
EP300 Q09472 1/20 0.33
PRKCE Q02156 1/20 0.32
PRKCQ Q04759 1/20 0.32
PRKCD Q05655 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
SCHEMBL7087960 0.81 LMNA (0.43) CYP2D6CYP2C19GRIK1FAAHALDH1A1
SCHEMBL28273731 0.78 EP300 (0.46) CYP2D6CYP2C19MAPTMAPK1FAAH
SCHEMBL27740651 0.78 GRIK1 (0.41) CYP2D6CYP2C19GRIK1FAAHALDH1A1
SCHEMBL328852 0.77 EP300 (0.36) CYP2D6CYP2C19MAPTMAPK1FAAH
SCHEMBL27885953 0.77 GRIK1 (0.34) CYP2D6CYP2C19GRIK1FAAHALDH1A1
SCHEMBL22576737 0.77 EP300 (0.44) FAAHCNR1CNR2EP300
SCHEMBL1682907 0.76
SCHEMBL7754867 0.76 EP300 (0.41) CYP2D6CYP2C19GRIK1FAAHALDH1A1
SCHEMBL29117916 0.76 LMNA (0.46) MAPTFAAHALDH1A1HPGDCNR1
Fluoride SCHEMBL28037720 0.75 LMNA (0.44) MAPTFAAHALDH1A1HPGDCNR1

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
CN-1427771-A In situ microencapsulated adhesive APPLETON PAPER INC (US) 2003-07-02 CN claimed
CN-1427771-A In situ microencapsulated adhesive APPLETON PAPER INC (US) 2003-07-02 CN disclosed