SCHEMBL2105428

SCHEMBL2105428

C[Si](C)(C)C#Cc1ccc(C#Cc2ccc(N)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.64
MAPT P10636 2/20 0.54
PIK3CA P42336 1/20 0.40
MTOR P42345 1/20 0.40
PDK1 Q15118 1/20 0.40
TLR9 Q9NR96 2/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ADK P55263 1/20 0.36
ACHE P22303 1/20 0.35

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
SCHEMBL2226274 0.98 APP (0.59) APPMAPTPIK3CAMTORPDK1
SCHEMBL25222336 0.91 APP (0.52) APPMAPTMEN1KMT2ANPC1
SCHEMBL1306505 0.88 APP (0.41) APPMAPTMEN1KMT2ANPC1
SCHEMBL5480062 0.86 CYP3A4 (0.52) APPMAPTNPC1RAB9AL3MBTL1
SCHEMBL1306384 0.85 GABRA1 (0.38) APPMAPTMEN1KMT2ANPC1
SCHEMBL19174201 0.81 CYP1A1 (0.48) APPMAPT
SCHEMBL9296640 0.80 APP (0.41) APPMAPTTLR9MEN1KMT2A
SCHEMBL864945 0.80 APP (1.00) APPMAPTPIK3CAMTORPDK1
SCHEMBL9611200 0.80 APP (1.00) APPMAPTPIK3CAMTORPDK1
SCHEMBL716385 0.79 GRM5 (0.54) MAPTMEN1KMT2ANPC1RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3628103-A1 NONAQUEOUS ELECTROLYTE, NONAQUEOUS ELECTROLYTE ENERGY STORAGE DEVICE, AND METHOD FOR PRODUCING NONAQUEOUS ELECTROLYTE ENERGY STORAGE DEVICE Robert Bosch GmbH (DE) 2020-04-01 EP disclosed
WO-2018224286-A1 NONAQUEOUS ELECTROLYTE, NONAQUEOUS ELECTROLYTE ENERGY STORAGE DEVICE, AND METHOD FOR PRODUCING NONAQUEOUS ELECTROLYTE ENERGY STORAGE DEVICE Lithium Energy and Power GmbH & Co. KG (DE) 2018-12-13 WO disclosed
US-8158203-B2 Methods of attaching or grafting carbon nanotubes to silicon surfaces and composite structures derived therefrom WILLIAM MARSH RICE UNIVERSITY (US) 2012-04-17 US disclosed
US-20090042136-A1 Carbon Nanotube-Silicon Composite Structures and Methods for Making Same NATIONAL SCIENCE FOUNDATION 2009-02-12 US disclosed
US-7393598-B2 Light emitting molecules and organic light emitting devices including light emitting molecules HCF PARTNERS, L.P. (US) 2008-07-01 US disclosed
WO-2005114708-A2 CARBON NANOTUBE-SILICON COMPOSITE STRUCTURES AND METHODS FOR MAKING SAME WILLIAM MARSH RICE UNIVERSITY (US) 2005-12-01 WO disclosed