SCHEMBL5328907

SCHEMBL5328907

CC(C)(C)C(C#Cc1ccccc1)(O[SiH3])c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
APP P05067 1/20 0.37
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
NPC1 O15118 1/20 0.32
MTOR P42345 1/20 0.32
RAB9A P51151 1/20 0.32
KCNN4 O15554 2/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL6564064 0.76 APP (0.44) MAPTAPPALDH1A1ALOX15NPC1
SCHEMBL6564084 0.74 APP (0.42) MAPTAPPMAPK1ALDH1A1NPC1
SCHEMBL6562532 0.73 MAPT (0.41) MAPTAPPALDH1A1ALOX15NPC1
SCHEMBL6563098 0.71 APP (0.48) MAPTAPPALDH1A1NPC1MTOR
SCHEMBL28592261 0.69 MAPT (0.49) MAPTAPPALDH1A1ALOX15
SCHEMBL523695 0.68 MAPT (0.51) MAPTAPPMAPK1ALDH1A1ALOX15
SCHEMBL2183993 0.68 APP (0.55) MAPTAPPALDH1A1ALOX15NPC1
SCHEMBL562815 0.68 APP (0.55) MAPTAPPALDH1A1NPC1MTOR
SCHEMBL6561445 0.68 MAPT (0.44) MAPTAPPALDH1A1NPC1MTOR
SCHEMBL6562626 0.68 MAPT (0.40) MAPTAPPNPC1MTORRAB9A

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-2007134421-A1 2-VINYL INDOLES, PYRIDO AND AZEPINO INDOLE DERIVATIVES, 2-ALKYNYL INDOLES, 2-ALKYNYL BENZO[b]FURANS, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF LAUTENS MARK (CA) 2007-11-29 WO disclosed