SCHEMBL4349768

SCHEMBL4349768

COC(C)OC(C)O[Si](COC(=O)c1ccccn1)(OC(C)OC(C)OC)OC(C)OC(C)OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
ALDH1A1 P00352 7/20 0.43
APP P05067 1/20 0.43
L3MBTL1 Q9Y468 5/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL3912008 0.88 APP (0.46) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL3911548 0.85 APP (0.50) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL3912714 0.81 PKM (0.56) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL3912380 0.80 CYP1A2 (0.40) ALDH1A1POLBKMT2AMEN1NPC1
SCHEMBL3910175 0.77 ADRB2 (0.42) ALDH1A1L3MBTL1KDM4EPOLBMAPT
SCHEMBL3912254 0.75 PKM (0.50) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL5317688 0.74 KDM4E (0.43) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL3915855 0.74 PKM (0.55) PKMALDH1A1APPL3MBTL1KDM4E
SCHEMBL27101915 0.73 ALDH1A1 (0.59) PKMALDH1A1APPL3MBTL1KDM4E
Ethyl Picolinate SCHEMBL29054125 0.73 CYP1A2 (0.62) PKMALDH1A1APPL3MBTL1KDM4E

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-20090277559-A1 METHOD FOR VULCANIZATION-ADHERING RUBBER COMPOSITION TO ADHERENT OF BRASS OR PLATED WITH BRASS, REINFORCING MEMBER FOR RUBBER ARTICLE, RUBBER-REINFORCING MEMBER COMPOSITE AND PNEUMATIC TIRE BRIDGESTONE CORPORATION (JP) 2009-11-12 US disclosed