SCHEMBL29952079

SCHEMBL29952079

CC(C)(C)[Si](C)(C)OCc1ccc(B(O)O)cc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.36
ENPP2 Q13822 6/20 0.34
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
TTR P02766 1/20 0.30
USP14 P54578 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
SCHEMBL7819729 0.85 ENPP2 (0.36) BACE1ENPP2CA1CA2
SCHEMBL9030829 0.79 LPL (0.46) BACE1ENPP2CA1CA2LPL
SCHEMBL3866189 0.79 DUT (0.35) ENPP2CA1CA2LPLLIPG
SCHEMBL1241080 0.77 ENPP2 (0.49) ENPP2LPLLIPG
SCHEMBL20320313 0.76 BACE1 (0.33) BACE1ENPP2CA1CA2
SCHEMBL4513196 0.76 GAA (0.37) BACE1
SCHEMBL6155969 0.76 IDO1 (0.38) BACE1
SCHEMBL22233890 0.75 ENPP2 (0.33) ENPP2CA1CA2
SCHEMBL23199584 0.74 KDM4E (0.35) BACE1
SCHEMBL20742245 0.74 BACE1 (0.45) BACE1ENPP2LIPG

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed