SCHEMBL456129

SCHEMBL456129

C[Si](C)(C)c1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.57
MAPT P10636 1/20 0.50
GRM5 P41594 8/20 0.46
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
THPO P40225 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CYP2D6 P10635 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL8607591 0.86 APP (0.57) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL14380097 0.84 GRM5 (0.51) APPGRM5FFAR1
SCHEMBL15471183 0.82 APP (0.52) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL16075811 0.80 APP (0.50) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL1086629 0.80 APP (0.50) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL12385268 0.80 APP (0.63) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL31026477 0.80 APP (0.34) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL2114741 0.79 APP (0.92) APPMAPTGRM5CYP1A2CYP3A4
Benzonitrile SCHEMBL4735388 0.79 TSHR (0.41) APPMAPTGRM5CYP1A2CYP3A4
SCHEMBL15471184 0.79 APP (0.48) APPMAPTGRM5CYP1A2CYP3A4

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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117845235-A Preparation method of cis-stilbene compound 深圳市环保科技集团股份有限公司 2024-04-09 CN claimed
US-10654985-B2 Microporous polymeric composition COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2020-05-19 US claimed
US-20180142075-A1 MICROPOROUS POLYMERIC COMPOSITION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-05-24 US claimed
EP-3303475-A1 MICROPOROUS POLYMERIC COMPOSITION Commonwealth Scientific and Industrial Research Organisation (AU) 2018-04-11 EP claimed
WO-2016187670-A1 MICROPOROUS POLYMERIC COMPOSITION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-01 WO claimed
US-20150283520-A1 MIXED MATRIX POLYMER COMPOSITIONS THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2015-10-08 US claimed
EP-2922618-A1 MIXED MATRIX POLYMER COMPOSITIONS Commonwealth Scientific and Industrial Research Organisation (AU) 2015-09-30 EP claimed
WO-2014078914-A1 MIXED MATRIX POLYMER COMPOSITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-05-30 WO claimed
CN-103080197-A A polymeric substrate having a glass-like surface and a chip made of said polymeric substrate SONY CORP 2013-05-01 CN claimed
WO-2011028342-A2 ENHANCED TRANSPORT SELECTIVITY USING NANOPARTICLE FILLED POLYMERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-03-10 WO claimed
US-20090324446-A1 APPARATUS FOR SENSING NITROAROMATICS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-12-31 US claimed
US-7510595-B2 Metal oxide nanoparticle filled polymers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-03-31 US claimed
WO-2007084169-A2 METAL OXIDE NANOPARTICLE FILLED POLYMERS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-07-26 WO claimed
US-20070137477-A1 Metal oxide nanoparticle filled polymers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-06-21 US claimed
US-7214543-B2 Method and apparatus for sensing nitroaromatics UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2007-05-08 US claimed
US-20030100123-A1 Method and apparatus for sensing nitroaromatics UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2003-05-29 US claimed
WO-2003031953-A2 METHOD AND APPARATUS FOR SENSING NITROAROMATICS UNIVERSITY OF FLORIDA (US) 2003-04-17 WO claimed
CN-113574369-B Gas detector 费加罗技研株式会社 2024-09-10 CN disclosed
WO-2003031953-A2 METHOD AND APPARATUS FOR SENSING NITROAROMATICS UNIVERSITY OF FLORIDA (US) 2003-04-17 WO disclosed
WO-2003031953-A2 METHOD AND APPARATUS FOR SENSING NITROAROMATICS UNIVERSITY OF FLORIDA (US) 2003-04-17 WO disclosed