SCHEMBL2802429

SCHEMBL2802429

Nc1ccc(-c2ccc3nc(OCCOCCOCCF)ccc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
NCF1 P14598 7/20 0.44
APP P05067 4/20 0.44
BACE1 P56817 2/20 0.38
RAD51 Q06609 1/20 0.38
PIK3CD O00329 2/20 0.37
PIK3CA P42336 2/20 0.37
PIK3CB P42338 2/20 0.37
PI4KA P42356 2/20 0.37
PIK3CG P48736 2/20 0.37
PI4KB Q9UBF8 2/20 0.37
CYP1B1 Q16678 1/20 0.36
PRKCZ Q05513 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
SCHEMBL2799408 0.90 PIK3CD (0.44) MAPTNCF1APPBACE1PIK3CD
SCHEMBL2799518 0.85 APP (0.48) MAPTAPP
SCHEMBL2800659 0.84 APP (0.54) MAPTAPP
SCHEMBL2803139 0.80 APP (0.60) MAPTNCF1APPRAD51
SCHEMBL2802333 0.79 CYP1B1 (0.44) MAPTNCF1APPBACE1CYP1B1
SCHEMBL13196949 0.79 MAPT (0.44) MAPTAPPBACE1
SCHEMBL2800843 0.77 APP (0.60) MAPTNCF1APP
SCHEMBL13196988 0.76 APP (0.53) MAPTAPP
SCHEMBL10076373 0.76 NCF1 (0.48) MAPTNCF1APPPIK3CDPIK3CA
SCHEMBL14908786 0.76 NCF1 (0.57) MAPTNCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100215579-A1 PHEN-NAPHTHALENE AND PHEN-QUINOLINE DERIVATIVES AND THEIR USE FOR BINDING AND IMAGING AMYLOID PLAQUES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (PA) 2010-08-26 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100215579-A1 PHEN-NAPHTHALENE AND PHEN-QUINOLINE DERIVATIVES AND THEIR USE FOR BINDING AND IMAGING AMYLOID PLAQUES APP, PSEN1, PSEN2 MAPT 6/4885NCF1 828/4885APP 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.