SCHEMBL28021975

SCHEMBL28021975

CCCc1cc[c]cc1.[AlH3]

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.43
LIPG Q9Y5X9 2/20 0.43
CA2 P00918 1/20 0.40
MGLL Q99685 1/20 0.38
PLK1 P53350 1/20 0.38
NISCH Q9Y2I1 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
THRB P10828 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 2/20 0.33
CTDSP1 Q9GZU7 2/20 0.33
HTR1D P28221 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL17731 0.97
SCHEMBL27871034 0.95 LPL (0.43) LPLLIPGCA2MGLLPLK1
SCHEMBL27887369 0.92 LPL (0.41) LPLLIPGCA2MGLLPLK1
SCHEMBL27629737 0.92 LPL (0.46) LPLLIPGCA2MGLLPLK1
Magnesium Chloride Anhydrous SCHEMBL27510294 0.88 LPL (0.39) LPLLIPGCA2MGLLPLK1
SCHEMBL27385918 0.88 LPL (0.39) LPLLIPGCA2MGLLPLK1
SCHEMBL8733194 0.88 ESR1 (0.47) LPLLIPGCA2MGLLKDM4E
SCHEMBL3780810 0.88 LPL (0.39) LPLLIPGCA2MGLLPLK1
SCHEMBL533509 0.83 MCL1 (0.47) LPLLIPGCA2MGLLPLK1
SCHEMBL28257690 0.83 TAAR1 (0.44) CA2

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-104854150-B Activator compositions, their preparation, and their use in catalysts 阿尔比马尔公司 2017-05-24 CN disclosed
CN-104854150-A Activator compositions, their preparation, and their use in catalysts ALBEMARLE CORP 2015-08-19 CN disclosed