SCHEMBL17133237

SCHEMBL17133237

CCCCNC(=O)N(CCN)CCC[Si](C)(OC)OC

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.34
EPHX1 P07099 3/20 0.34
DPP7 Q9UHL4 1/20 0.33
RRM1 P23921 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MMP2 P08253 1/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
BCHE P06276 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL17133252 0.88 ACHE (0.33) ACHEEPHX1DPP7RRM1ALDH1A1
SCHEMBL17133208 0.88 ACHE (0.35) ACHEEPHX1DPP7RRM1ALDH1A1
SCHEMBL17133273 0.86 EPHX1 (0.42) ACHEEPHX1HTT
SCHEMBL19333852 0.85 CA14 (0.32) EPHX1
SCHEMBL2616731 0.84 EPHX1 (0.37) ACHEEPHX1
SCHEMBL17133235 0.83
SCHEMBL17133212 0.81 ACHE (0.34) ACHEEPHX1DPP7RRM1ALDH1A1
SCHEMBL17133230 0.78
SCHEMBL15906240 0.78 EPHX1 (0.48) EPHX1DPP7RRM1GNAI3GNAO1
SCHEMBL23637648 0.78 CA12 (0.41) EPHX1DPP7RRM1ALDH1A1MMP2

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-2015144384-A1 SILANE CONTAINING RESPECTIVELY AT LEAST TWO ALKOXY GROUPS AND A GUANIDONO OR CARBAMIDE GROUP EVONIK DEGUSSA GMBH (DE) 2015-10-01 WO disclosed