SCHEMBL28186333

SCHEMBL28186333

C=C(C)C(=O)OCCc1cccc(CCc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HCAR2 Q8TDS4 1/20 0.45
MGLL Q99685 1/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
AKR1B10 O60218 2/20 0.44
AKR1B1 P15121 2/20 0.44
ALOX5 P09917 2/20 0.44
TDP1 Q9NUW8 3/20 0.44
THRB P10828 1/20 0.44
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43

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
SCHEMBL27973892 0.92 HCAR2 (0.49) APPL3MBTL1HCAR2ESR1ESR2
SCHEMBL42893 0.92 HCAR2 (0.51) APPL3MBTL1HCAR2ESR1ESR2
Methane SCHEMBL4468486 0.91 HCAR2 (0.50) APPL3MBTL1HCAR2ESR1ESR2
Methacrylic Acid SCHEMBL8131805 0.89 HCAR2 (0.49) APPL3MBTL1HCAR2ESR1ESR2
SCHEMBL150565 0.88 MGLL (0.52) APPL3MBTL1HCAR2MGLLAKR1B1
SCHEMBL29734670 0.88 MGLL (0.52) APPL3MBTL1HCAR2MGLLAKR1B1
SCHEMBL28187045 0.88 ALDH1A1 (0.49) L3MBTL1AKR1B10AKR1B1TDP1ALDH1A1
Ethylene Glycol SCHEMBL6490846 0.88 HCAR2 (0.47) APPL3MBTL1HCAR2ESR1ESR2
SCHEMBL27551658 0.87 LOXL2 (0.44) APPL3MBTL1TDP1THRBALDH1A1
SCHEMBL7937982 0.86 HCAR2 (0.46) APPL3MBTL1HCAR2ESR1ESR2

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
CN-108699184-B (methyl) acrylic-based compositions, coating and solidified body comprising being somebody's turn to do (methyl) acrylic-based compositions 三菱瓦斯化学株式会社 2019-08-09 CN disclosed
CN-107406654-B Resin composition and molded article using same 三菱瓦斯化学株式会社 2019-03-08 CN disclosed
CN-108699184-A (methyl) acrylic-based compositions include the coating and firming body for being somebody's turn to do (methyl) acrylic-based compositions 三菱瓦斯化学株式会社 2018-10-23 CN disclosed
CN-107406654-A Resin composition and molded article using same 三菱瓦斯化学株式会社 2017-11-28 CN disclosed