SCHEMBL5606987

SCHEMBL5606987

CCCCCC(N)NCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.38
DPP7 Q9UHL4 2/20 0.33
TP53 P04637 1/20 0.33
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
RRM1 P23921 1/20 0.30
LMNA P02545 1/20 0.30
SPHK1 Q9NYA1 1/20 0.30
SLC2A1 P11166 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
SCHEMBL5607295 0.85 LMNA (0.45) OPRM1DPP7TP53GNAI3GNAO1
SCHEMBL28823234 0.84 LMNA (0.47) OPRM1DPP7TP53GNAI3GNAO1
SCHEMBL15661607 0.83
SCHEMBL41076 0.81 OPRM1 (0.42) OPRM1TP53LMNASPHK1
SCHEMBL384304 0.81
SCHEMBL10457082 0.78 OPRM1 (0.48) OPRM1DPP7TP53GNAI3GNAO1
SCHEMBL919346 0.78
SCHEMBL28622630 0.77 ADRB2 (0.33)
SCHEMBL9691923 0.77 OPRM1 (0.46) OPRM1DPP7TP53GNAI3GNAO1
SCHEMBL28542120 0.77 OPRM1 (0.46) OPRM1DPP7TP53GNAI3GNAO1

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-7279173-B2 Object having a microbicide coating, method for the production thereof and use of the same LEIBNIZ-INSTITUT FUER NEUE MATERIALIEN GEMEINNUETZIGE GMBH (DE) 2007-10-09 US claimed