SCHEMBL16623336

SCHEMBL16623336

COc1ccc2nc(-c3ccc(NC(=O)c4ccc(C)cc4)cc3)sc2c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.64
LMNA P02545 1/20 0.64
NPC1 O15118 4/20 0.63
RAB9A P51151 4/20 0.63
APP P05067 3/20 0.63
SCD O00767 4/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
TP53 P04637 2/20 0.60
MMP2 P08253 1/20 0.56
MMP9 P14780 1/20 0.56
MMP8 P22894 1/20 0.56
MMP13 P45452 1/20 0.56

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
SCHEMBL1985009 0.95 SCD (0.67) MAPTLMNANPC1RAB9AAPP
SCHEMBL2193639 0.92 APP (0.63) MAPTLMNANPC1RAB9AAPP
SCHEMBL16623333 0.92 APP (0.77) MAPTLMNANPC1RAB9AAPP
SCHEMBL2191507 0.91 APP (0.71) MAPTLMNANPC1RAB9AAPP
SCHEMBL2192963 0.91 APP (0.71) MAPTLMNANPC1RAB9AAPP
SCHEMBL1983311 0.90 MMP2 (0.69) MAPTLMNANPC1RAB9AAPP
SCHEMBL2193573 0.90 APP (0.60) MAPTLMNANPC1RAB9AAPP
SCHEMBL12509332 0.89 APP (0.59) MAPTLMNANPC1RAB9AAPP
SCHEMBL2196579 0.89 APP (0.59) MAPTLMNANPC1RAB9AAPP
SCHEMBL2192191 0.89 APP (0.72) MAPTLMNANPC1RAB9AAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed