SCHEMBL5604072

SCHEMBL5604072

CCC(NC(C)NCC(=O)O)[Si](OC)(OC)OC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.33
ACE P12821 1/20 0.33
CPA1 P15085 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
EGLN1 Q9GZT9 1/20 0.31
ECE1 P42892 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
PTGS2 P35354 1/20 0.30
TDP1 Q9NUW8 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
Ammonia Solution, Strong SCHEMBL19423968 0.78
SCHEMBL5604076 0.74 EGLN1 (0.31) EGLN1
SCHEMBL9233484 0.73
SCHEMBL5702381 0.72 CA2 (0.33) MME
SCHEMBL56081 0.72
SCHEMBL144037 0.71 SIGMAR1 (0.42) MAPT
SCHEMBL448123 0.70
SCHEMBL7093179 0.70
Hydrochloric Acid SCHEMBL8927852 0.70 SIGMAR1 (0.41) ALDH1A1LMNAMAPT
SCHEMBL1810893 0.70 MMP1 (0.32)

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-20070299214-A1 trimethoxysilyl-group-terminated polyoxypropylene polymer containing a reactive silicon group, and being crosslinkable through the formation of a siloxane bonding; neodecanoic acid or tin carbonate as curing catalyst; adhesion-imparting agent aminopropyltrimethoxysilane; one-component sealant, adhesives KANEKA CORPORATION (JP) 2007-12-27 US disclosed