SCHEMBL28384306

SCHEMBL28384306

O=C(c1ccccc1)c1ccccc1Oc1cccc(OCCO)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.49
DRD1 P21728 1/20 0.49
DRD3 P35462 1/20 0.49
GAA P10253 1/20 0.49
SRC P12931 1/20 0.44
TGFBR1 P36897 1/20 0.44
ABCB1 P08183 5/20 0.43
ELANE P08246 1/20 0.43
CCNE2 O96020 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
LTB4R Q15722 3/20 0.41
LTB4R2 Q9NPC1 3/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 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
SCHEMBL2228867 0.85 DRD2 (0.62) DRD2DRD1DRD3GAAABCB1
SCHEMBL28382567 0.83 SRC (0.49) DRD2DRD1DRD3GAASRC
SCHEMBL28380255 0.81 GAA (0.68) DRD2DRD1DRD3GAAABCB1
SCHEMBL574716 0.80 MAPT (0.63) DRD2DRD1DRD3GAACCNE2
SCHEMBL4635208 0.79 MAPT (0.50) DRD2DRD1DRD3ABCB1ELANE
SCHEMBL30693726 0.79 GAA (0.53) DRD2DRD1DRD3GAAABCB1
SCHEMBL9282306 0.79 ELANE (0.61) DRD2DRD1DRD3GAASRC
SCHEMBL15104997 0.78 MAPT (0.47) DRD2DRD1DRD3ABCB1ELANE
SCHEMBL22373558 0.77 ALDH1A1 (0.64) DRD2DRD1DRD3GAAABCB1
SCHEMBL21549819 0.77 ALDH1A1 (0.64) DRD2DRD1DRD3GAAABCB1

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
CN-108383987-B High-char-forming low-smoke flame-retardant anti-dripping copolyester based on aromatic ketone structure and preparation method thereof 四川大学 2020-03-17 CN disclosed