SCHEMBL9764056

SCHEMBL9764056

CC=CC(=O)OCCC[Si](C)(C)O[Si](C)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.38
AKR1B10 O60218 5/20 0.37
AKR1B1 P15121 5/20 0.37
TDP1 Q9NUW8 1/20 0.36
ALOX5 P09917 1/20 0.36
MAPT P10636 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TTR P02766 1/20 0.34
EGFR P00533 1/20 0.34
BTK Q06187 1/20 0.34
MAOB P27338 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
SCHEMBL1398281 0.91 HCAR2 (0.37) HCAR2AKR1B10AKR1B1ALOX5MAPT
SCHEMBL9763748 0.89 HCAR2 (0.35) HCAR2AKR1B10AKR1B1ALOX5MAPT
SCHEMBL9763728 0.85 THRB (0.48) HCAR2AKR1B10AKR1B1TDP1MAPT
SCHEMBL22092326 0.85 HCAR2 (0.40) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL4623580 0.85 HCAR2 (0.40) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL16205020 0.84 HCAR2 (0.38) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL7794491 0.84 HCAR2 (0.39) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL17373023 0.83 HCAR2 (0.41) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL17287255 0.83 HCAR2 (0.41) HCAR2AKR1B10AKR1B1TDP1ALOX5
SCHEMBL10629493 0.83 HCAR2 (0.41) HCAR2AKR1B10AKR1B1TDP1ALOX5

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
US-4988788-A Room temperature-curable coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-01-29 US claimed