SCHEMBL5081766

SCHEMBL5081766

Cc1ccc([Si](C)(C)OCC2(CO[Si](C)(C)c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.36
APEX1 P27695 1/20 0.33
KCNQ2 O43526 2/20 0.32
KIF11 P52732 1/20 0.32
C3AR1 Q16581 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PGR P06401 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
SYK P43405 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
SCHEMBL5085336 0.94 PDK2 (0.33) PDK2
SCHEMBL5080887 0.92 PDK2 (0.32) PDK2
SCHEMBL5082280 0.89 PDK2 (0.33) PDK2
SCHEMBL5078718 0.89 APEX1 (0.39) APEX1KCNQ2NPSR1CYP1A2CYP3A4
SCHEMBL5940616 0.88 PDK2 (0.41) PDK2CYP1A2CYP2C9
SCHEMBL5080869 0.83 APEX1 (0.35) PDK2APEX1
SCHEMBL5082359 0.81 SMN1; SMN2 (0.34) APEX1CYP1A2
SCHEMBL5081819 0.79 CYP2C9 (0.33) PDK2APEX1NPSR1CYP2C9
SCHEMBL5081773 0.78 APEX1 (0.33) PDK2APEX1KCNQ2NPSR1CYP1A2
SCHEMBL5082343 0.78 APEX1 (0.39) PDK2APEX1KCNQ2CYP1A2CYP3A4

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