SCHEMBL3974341

SCHEMBL3974341

OCCOCCOCCOCCOCCOCCOCCOC(CO)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
RECQL P46063 1/20 0.44
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
APP P05067 4/20 0.33
MAPK1 P28482 2/20 0.33
KCNH3 Q9ULD8 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 2/20 0.33
KCNH2 Q12809 3/20 0.32
CYP2D6 P10635 3/20 0.32
CYP3A4 P08684 3/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
USP2 O75604 2/20 0.32
ABCB11 O95342 1/20 0.32
CHRM2 P08172 1/20 0.32
ADRA2A P08913 1/20 0.32
DRD2 P14416 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
SCHEMBL1412775 0.90 ALDH1A1 (0.50) ALDH1A1RECQLGAAKCNH2CYP2D6
Acrylic Acid SCHEMBL3028297 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3020480 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3032188 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3025841 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3032250 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3025637 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3030541 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Acrylic Acid SCHEMBL3032168 0.89 THRB (0.38) ALDH1A1RECQLMEN1KMT2AGAA
Methacrylic Acid SCHEMBL3021473 0.88 MTNR1A (0.36) ALDH1A1RECQLMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009051293-A1 INK COMPOSITION FOR COLOR FILTER, METHOD FOR PREPARING A COLOR FILTER USING THE SAME, AND COLOR FILTER CHEIL INDUSTRIES INC. (KR) 2009-04-23 WO disclosed