SCHEMBL28546355

SCHEMBL28546355

CCc1ccccc1[PH](=O)OC(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
MGLL Q99685 1/20 0.32
TSHR P16473 3/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30

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
SCHEMBL11325395 0.83 ADRA2C (0.38) GABRA1GABRB2ALDH1A1TSHRADRA2A
SCHEMBL7121952 0.80 GABRA1 (0.38) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL28541537 0.79 ALDH1A1 (0.36) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL777172 0.79 L3MBTL1 (0.40) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL779740 0.77 MAPT (0.39) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL28550187 0.77 TSHR (0.35) L3MBTL1ALDH1A1POLBTSHR
SCHEMBL28542296 0.76 HTT (0.35) MAPTNPSR1L3MBTL1ALDH1A1POLB
SCHEMBL28552223 0.74 L3MBTL1 (0.37) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL28545748 0.74 MAPT (0.32) MAPTNPSR1L3MBTL1ALDH1A1ADRA2A
SCHEMBL1425117 0.73 GABRA1 (0.42) GABRA1GABRB2MAPTNPSR1L3MBTL1

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-109293805-B Olefin polymerization solid catalytic component, component preparation method and catalyst system thereof 中国石油天然气股份有限公司 2021-03-09 CN claimed
CN-109293805-B Olefin polymerization solid catalytic component, component preparation method and catalyst system thereof 中国石油天然气股份有限公司 2021-03-09 CN disclosed