SCHEMBL3354848

SCHEMBL3354848

CN(C(=O)O)c1ccc(-c2ccc3nc(OCCOCCOCCO)ccc3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.38
ATM Q13315 9/20 0.37
SRC P12931 2/20 0.36
APP P05067 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SLC6A9 P48067 1/20 0.35
LTB4R Q15722 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PI4KA P42356 1/20 0.35
PIK3CG P48736 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
RARB P10826 1/20 0.35
RARG P13631 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
SCHEMBL2799472 0.88 APP (0.48) APPALDH1A1LTB4RPIK3CDPIK3CA
SCHEMBL2801574 0.87 PAX8 (0.43) BRAFATMSRCAPP
SCHEMBL3359159 0.84 APP (0.47) APPALDH1A1RARB
SCHEMBL3358155 0.82 APP (0.50) APPALDH1A1RARB
SCHEMBL2799408 0.80 PIK3CD (0.44) SRCAPPLTB4RPIK3CDPIK3CA
SCHEMBL2802411 0.80 APP (0.47) APPLTB4RPIK3CDPIK3CAPIK3CB
SCHEMBL2799518 0.78 APP (0.48) APPALDH1A1
SCHEMBL2567719 0.74 APP (0.50) APP
SCHEMBL2567715 0.74 APP (0.50) APP
SCHEMBL13196988 0.73 APP (0.53) APPALDH1A1LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2144916-A1 PHEN-NAPHTHALENE AND PHEN-QUINOLINE DERIVATIVES AND THEIR USE FOR BINDING AND IMAGING AMYLOID PLAQUES The Trustees of the University of Pennsylvania (US) 2010-01-20 EP disclosed
WO-2008124812-A1 PHEN-NAPHTHALENE AND PHEN-QUINOLINE DERIVATIVES AND THEIR USE FOR BINDING AND IMAGING AMYLOID PLAQUES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2008-10-16 WO disclosed