SCHEMBL896888

SCHEMBL896888

CCO[Si](CCCNC(N)=O)(OCC)OCC.CCO[Si](CCCNC(N)=O)(OCC)OCC

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ACHE P22303 7/20 0.33
EPHX1 P07099 5/20 0.33
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL35515 1.00 CA12 (0.35) CA12CA1CA2CA9MEN1
Methyl Alcohol SCHEMBL22551142 0.98 CA12 (0.34) CA12CA1CA2CA9MEN1
SCHEMBL16666204 0.98 CA12 (0.34) CA12CA1CA2CA9MEN1
SCHEMBL29040175 0.98 CA12 (0.34) CA12CA1CA2CA9MEN1
Alcohol SCHEMBL28802362 0.96 CA12 (0.33) CA12CA1CA2CA9MEN1
SCHEMBL28382678 0.95 CA12 (0.33) CA12CA1CA2CA9MEN1
SCHEMBL679996 0.94 CA12 (0.38) CA12CA1CA2CA9MEN1
SCHEMBL9985974 0.93 EPHX1 (0.33) CA12CA1CA2CA9MEN1
SCHEMBL10589981 0.93 PAOX (0.38) CA12CA1CA2CA9MEN1
SCHEMBL28388584 0.93 CA12 (0.32) CA12CA1CA2CA9MEN1

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-20120082791-A1 Coating Composition Amenable to Elastomeric Substrates LIVERSAGE ROBERT RICHARD (US) 2012-04-05 US disclosed