SCHEMBL4354348

SCHEMBL4354348

CCCCCCCCC(C)(C(=O)C(C)(CCCCCCCC)[Si](OC(C)OC(C)OC)(OC(C)OC(C)OC)OC(C)OC(C)OC)[Si](OC(C)OC(C)OC)(OC(C)OC(C)OC)OC(C)OC(C)OC

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.35
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
ACAT1 P24752 1/20 0.33
SOAT1 P35610 1/20 0.33
LMNA P02545 2/20 0.32
SMPD1 P17405 1/20 0.30
ZDHHC7 Q9NXF8 1/20 0.30
GGPS1 O95749 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL4350506 1.00 CES2 (0.35) CES2MAPTKDM4ETP53CYP3A4
SCHEMBL4354828 1.00 CES2 (0.35) CES2MAPTKDM4ETP53CYP3A4
SCHEMBL4356198 0.99 CES2 (0.33) CES2MAPTKDM4ETP53CYP3A4
SCHEMBL4345966 0.94 CA1 (0.30)
SCHEMBL4342571 0.88 LMNA (0.32) CYP3A4TSHRLMNA
SCHEMBL4355377 0.83 CES2 (0.35) CES2MAPTLMNASMPD1ZDHHC7
SCHEMBL4350603 0.83 CES2 (0.35) CES2MAPTLMNASMPD1ZDHHC7
SCHEMBL4344813 0.83 CES2 (0.35) CES2MAPTLMNASMPD1ZDHHC7
SCHEMBL4351874 0.81 CES2 (0.33) CES2
SCHEMBL3912723 0.78 CES2 (0.43) CES2MAPTKDM4ETP53CYP3A4

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