SCHEMBL935472

SCHEMBL935472

COC(CCN)(CCCN)OC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.32
KCNH2 Q12809 1/20 0.32
FDPS P14324 1/20 0.30
PDE3A Q14432 1/20 0.30
NFKB1 P19838 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
SCHEMBL17530083 0.78 KIF11 (0.34) KIF11KCNH2FDPSPDE3ANFKB1
SCHEMBL935112 0.78
SCHEMBL728089 0.77
SCHEMBL934841 0.75 KIF11 (0.32) KIF11
SCHEMBL1440096 0.71
SCHEMBL6444266 0.71 CA12 (0.39)
SCHEMBL9312314 0.70 KIF11 (0.33) KIF11KCNH2FDPSPDE3ANFKB1
SCHEMBL15289609 0.70
SCHEMBL14779120 0.69 TSHR (0.35) FDPS
Hydrochloric Acid SCHEMBL14876676 0.69

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
WO-2011006808-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS WACKER CHEMIE AG (DE) 2011-01-20 WO disclosed