SCHEMBL2865734

SCHEMBL2865734

Nc1ccc(C#Cc2ccc(I)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 11/20 0.74
MAPT P10636 2/20 0.61
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
PDK1 Q15118 1/20 0.39
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ADK P55263 1/20 0.35
TLR9 Q9NR96 1/20 0.34

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
SCHEMBL9611200 0.86 APP (1.00) APPMAPTMEN1KMT2APIK3CA
SCHEMBL864945 0.86 APP (1.00) APPMAPTMEN1KMT2APIK3CA
SCHEMBL20015758 0.86 APP (0.47) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL1306241 0.86 APP (0.47) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL2037596 0.83 APP (0.48) APPMAPT
SCHEMBL25837 0.83
SCHEMBL21903463 0.80 APP (0.88) APPMAPTMEN1KMT2APIK3CA
Hydrochloric Acid SCHEMBL7893866 0.80
SCHEMBL16675512 0.79 CYP1A1 (0.50) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL16675523 0.79 CYP1A1 (0.50) APPMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023150908-A1 LIQUID CRYSTAL COMPOSITION AND PREPARATION METHOD THEREFOR, AND DISPLAY PANEL 京东方科技集团股份有限公司 2023-08-17 WO disclosed
US-8362559-B2 Hybrid molecular electronic devices containing molecule-functionalized surfaces for switching, memory, and sensor applications and methods for fabricating same WILLIAM MARSH RICE UNIVERSITY (US) 2013-01-29 US disclosed
US-8362559-B2 Hybrid molecular electronic devices containing molecule-functionalized surfaces for switching, memory, and sensor applications and methods for fabricating same WILLIAM MARSH RICE UNIVERSITY (US) 2013-01-29 US disclosed
US-7838077-B2 Functionalized, hydrogen-passivated silicon surfaces WILLIAM MARSH RICE UNIVERSITY (US) 2010-11-23 US disclosed
US-7838077-B2 Functionalized, hydrogen-passivated silicon surfaces WILLIAM MARSH RICE UNIVERSITY (US) 2010-11-23 US disclosed
US-20100252824-A1 Hybrid Molecular Electronic Devices Containing Molecule-Functionalized Surfaces for Switching, Memory, and Sensor Applications and Methods for Fabricating Same WILLIAM MARSH RICE UNIVERSITY (US) 2010-10-07 US disclosed
US-20100252824-A1 Hybrid Molecular Electronic Devices Containing Molecule-Functionalized Surfaces for Switching, Memory, and Sensor Applications and Methods for Fabricating Same WILLIAM MARSH RICE UNIVERSITY (US) 2010-10-07 US disclosed
US-20090269593-A1 FUNCTIONALIZED, HYDROGEN-PASSIVATED SILICON SURFACES WILLIAM MARSH RICE UNIVERSITY (US) 2009-10-29 US disclosed
US-20090269593-A1 FUNCTIONALIZED, HYDROGEN-PASSIVATED SILICON SURFACES WILLIAM MARSH RICE UNIVERSITY (US) 2009-10-29 US disclosed
US-7527831-B2 Method of making a molecule-surface interface WILLIAM MARSH RICE UNIVERSITY (US) 2009-05-05 US disclosed
US-7527831-B2 Method of making a molecule-surface interface WILLIAM MARSH RICE UNIVERSITY (US) 2009-05-05 US disclosed
US-20070249180-A1 METHOD OF MAKING A MOLECULE-SURFACE INTERFACE WILLIAM MARSH RICE UNIVERSITY (US) 2007-10-25 US disclosed
US-20070249180-A1 METHOD OF MAKING A MOLECULE-SURFACE INTERFACE WILLIAM MARSH RICE UNIVERSITY (US) 2007-10-25 US disclosed
US-7176146-B2 Method of making a molecule-surface interface WILLIAM MARSH RICE UNIVERSITY (US) 2007-02-13 US disclosed
WO-2004046099-A2 METHOD OF MAKING A MOLECULE-SURFACE INTERFACE WILLIAM MARSH RICE UNIVERSITY (US) 2004-06-03 WO disclosed
US-20040023479-A1 Method of making a molecule-surface interface WILLIAM MARSH RICE UNIVERSITY 2004-02-05 US disclosed