SCHEMBL4559222

SCHEMBL4559222

COc1ccc(C2(O)c3ccc(O[Si](C)(C)C(C)(C)C)c(C)c3OCC2c2cccc(O[Si](C)(C)C(C)(C)C)c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.31
LMNA P02545 1/20 0.31
CFTR P13569 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL24103983 0.90 PREP (0.33)
SCHEMBL12063383 0.90 ALDH1A1 (0.33) BACE1LMNAALDH1A1
SCHEMBL12062893 0.82
SCHEMBL2566790 0.81 ALOX15 (0.39) BACE1LMNAALDH1A1
SCHEMBL2568306 0.78 ALOX15 (0.38) BACE1LMNAALDH1A1
SCHEMBL240709 0.77 ALOX15 (0.37) ALDH1A1
SCHEMBL2563436 0.76 ALOX15 (0.40) BACE1LMNAALDH1A1
SCHEMBL2568812 0.76 ALOX15 (0.38) BACE1LMNA
SCHEMBL25892517 0.75 PREP (0.33)
SCHEMBL13673338 0.75 SMN1; SMN2 (0.38) BACE1LMNAALDH1A1

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-7601855-B2 anticancer agents; chemotherapeutic selective agents NOVOGEN RESEARCH PTY LTD (AU) 2009-10-13 US disclosed