SCHEMBL16205162

SCHEMBL16205162

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

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.37
AKR1B10 O60218 5/20 0.36
AKR1B1 P15121 5/20 0.36
MAPT P10636 1/20 0.35
ALOX5 P09917 1/20 0.35
ATM Q13315 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
EGFR P00533 1/20 0.33
BTK Q06187 1/20 0.33
MAOB P27338 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL16205020 0.91 HCAR2 (0.38) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL5898832 0.88 HCAR2 (0.38) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL1398281 0.87 HCAR2 (0.37) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL22367583 0.87 ALOX5 (0.39) HCAR2AKR1B10AKR1B1ALOX5ATM
SCHEMBL17373023 0.82 HCAR2 (0.41) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL17287255 0.82 HCAR2 (0.41) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL10629493 0.82 HCAR2 (0.41) HCAR2AKR1B10AKR1B1ALOX5ATM
SCHEMBL22092326 0.81 HCAR2 (0.40) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL4623580 0.81 HCAR2 (0.40) HCAR2AKR1B10AKR1B1MAPTALOX5
SCHEMBL9764056 0.81 HCAR2 (0.38) HCAR2AKR1B10AKR1B1MAPTALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052140-B1 NON-SELF-ADHERENT COATING MATERIALS ROCHAL IND LLC (US) 2019-05-01 EP disclosed
EP-3052140-A1 NON-SELF-ADHERENT COATING MATERIALS Rochal Industries, LLC (US) 2016-08-10 EP disclosed
WO-2015050682-A1 NON-SELF-ADHERENT COATING MATERIALS ROCHAL INDUSTRIES, LLP (US) 2015-04-09 WO disclosed
US-8877882-B1 Non-self-adherent coating materials ROCHAL INDUSTRIES LLP (US) 2014-11-04 US disclosed