SCHEMBL28101366

SCHEMBL28101366

CCO[Si](OCC)c1ccccc1CC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
GABRA1 P14867 4/20 0.37
GABRB2 P47870 4/20 0.37
MGLL Q99685 1/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
ATM Q13315 1/20 0.32
TP53 P04637 2/20 0.31
CYP2D6 P10635 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
NLRP3 Q96P20 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
SCHEMBL28297275 0.90 L3MBTL1 (0.37) MAPTL3MBTL1NPSR1GABRA1GABRB2
SCHEMBL27447852 0.81 GABRA1 (0.38) MAPTL3MBTL1NPSR1GABRA1GABRB2
SCHEMBL2925637 0.75 GABRA1 (0.44) MAPTL3MBTL1NPSR1GABRA1GABRB2
SCHEMBL28227547 0.72 HPGD (0.40) TSHRHPGDCYP2D6LMNA
SCHEMBL28204376 0.71 ALDH1A1 (0.36)
SCHEMBL3420693 0.69 LTA4H (0.37) L3MBTL1NPSR1TSHRTP53
SCHEMBL25425763 0.68 GABRA1 (0.58) MAPTL3MBTL1NPSR1GABRA1GABRB2
SCHEMBL29390847 0.68 GABRA1 (0.58) MAPTL3MBTL1NPSR1GABRA1GABRB2
SCHEMBL36294 0.68 GABRA1 (0.58) MAPTL3MBTL1NPSR1GABRA1GABRB2
Methoxymethane SCHEMBL27728603 0.66 GABRA1 (0.50) MAPTL3MBTL1NPSR1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103492503-B The coating composition of containing silicone resin 默克专利有限公司 2016-10-12 CN disclosed