SCHEMBL10696834

SCHEMBL10696834

CC(C)(C)c1ccc2nc3c(c(NCc4ccc(F)cc4)c2c1)CCCC3

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 15/20 0.62
BCHE P06276 8/20 0.55
BACE1 P56817 1/20 0.55
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
APP P05067 1/20 0.49

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
SCHEMBL9249591 0.91 ACHE (0.75) ACHEBCHEBACE1KDM4EMEN1
SCHEMBL9253566 0.89 ACHE (0.64) ACHEBCHEBACE1KDM4EMEN1
SCHEMBL9257216 0.83 ACHE (0.76) ACHEBCHEBACE1KDM4EMEN1
SCHEMBL9258030 0.81 ACHE (0.68) ACHEBCHECYP1A2APP
SCHEMBL9253349 0.81 ACHE (0.58) ACHEBCHEBACE1KDM4EMEN1
SCHEMBL9257120 0.81 ACHE (0.60) ACHEBCHEBACE1
SCHEMBL9259460 0.80 ACHE (0.71) ACHEBCHE
SCHEMBL9259739 0.77 ACHE (0.72) ACHEMEN1HTTKMT2A
SCHEMBL9250740 0.76 ACHE (0.53) ACHEBCHEHTTAPP
SCHEMBL29062229 0.75 ACHE (0.59) ACHEBCHEBACE1KDM4EMEN1

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-0282959-A2 Substituted 9-amino-tetrahydro-acridines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-09-21 EP disclosed