SCHEMBL5082307

SCHEMBL5082307

CCCC[Si](C)(C)OCC1(CO[Si](C)(C)CCCC)c2ccccc2-c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 4/20 0.36
CYP2C9 P11712 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
PDK2 Q15119 3/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 2/20 0.33
CYP19A1 P11511 1/20 0.33
APEX1 P27695 1/20 0.33
PGR P06401 1/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ITGA4 P13612 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL5082272 0.94 CYP2C9 (0.33) CYP2C19CYP2C9NPSR1PDK2KMT2A
SCHEMBL5078657 0.93 CYP2C9 (0.33) CYP2C19CYP2C9NPSR1PDK2KMT2A
SCHEMBL5084634 0.92 CYP2C9 (0.34) CYP2C19CYP2C9NPSR1PDK2KMT2A
SCHEMBL5078725 0.90 APEX1 (0.34) CYP2C19CYP2C9NPSR1PDK2KMT2A
SCHEMBL5085278 0.88 PDK2 (0.38) CYP2C19CYP2C9NPSR1PDK2CYP1A2
SCHEMBL5084660 0.85 ALDH1A1 (0.33) CYP2C19PDK2KMT2ACYP1A2APEX1
SCHEMBL5082365 0.84 SMN1; SMN2 (0.31) CYP2C19KMT2ACYP1A2APEX1PGR
SCHEMBL5078647 0.83 APEX1 (0.36) CYP2C19CYP2C9NPSR1PDK2KMT2A
SCHEMBL5081723 0.82 PDK2 (0.33) CYP2C19CYP2C9NPSR1PDK2
SCHEMBL5082316 0.80 APEX1 (0.35) CYP2C9KMT2AL3MBTL1TDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US claimed
US-7323431-B2 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-01-29 US disclosed
US-20060142146-A1 Catalyst for olefin polymerization and use of the same CHINA PETROLEUM & CHEMICAL CORPORATION 2006-06-29 US disclosed