SCHEMBL5494749

SCHEMBL5494749

[C-]#[N+]c1ccc(C#Cc2[c]cccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.32
KCNH2 Q12809 2/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL1822569 0.79 APP (0.55) APPKCNH2MAPT
SCHEMBL5586491 0.77 APP (0.36) APPKCNH2MAPT
SCHEMBL8093294 0.77 KCNH2 (0.50) APPKCNH2MAPT
SCHEMBL6513167 0.74 APP (0.32) APP
SCHEMBL5403604 0.73 ALDH1A1 (0.47) APPKCNH2MAPT
SCHEMBL28775743 0.73 PIK3CA (0.40) APPKCNH2
SCHEMBL8988350 0.72 TRPA1 (0.39) APPKCNH2MAPT
SCHEMBL6514875 0.71 RARB (0.47)
SCHEMBL21858024 0.70 ASIC3 (0.40)
SCHEMBL5492278 0.70 APP (0.33) APPMAPT

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
EP-1474832-A4 METHOD AND SYSTEM FOR MOLECULAR CHARGE STORAGE FIELD EFFECT TRANSISTOR UNIV CALIFORNIA (US) 2007-08-29 EP disclosed
EP-1474832-A1 METHOD AND SYSTEM FOR MOLECULAR CHARGE STORAGE FIELD EFFECT TRANSISTOR The Regents of the University of California (US) 2004-11-10 EP disclosed
WO-2003052835-A1 METHOD AND SYSTEM FOR MOLECULAR CHARGE STORAGE FIELD EFFECT TRANSISTOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-06-26 WO disclosed