SCHEMBL20794833

SCHEMBL20794833

Cc1ccc(CN[C@H]2CCN3CCOC[C@H]3C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.48
BACE1 P56817 4/20 0.48
BCHE P06276 2/20 0.46
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
RB1 P06400 3/20 0.37
TACR1 P25103 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MTOR P42345 1/20 0.36
EBP Q15125 1/20 0.36
DHCR7 Q9UBM7 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.35
FAAH O00519 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MGLL Q99685 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
SCHEMBL20794834 1.00 ACHE (0.48) ACHEBACE1BCHENPC1GAA
SCHEMBL20766029 0.87 BCHE (0.48) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL23686924 0.87 BCHE (0.48) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL20794526 0.87 BCHE (0.48) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL20766012 0.87 BCHE (0.48) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL20780641 0.83 ACHE (0.51) ACHEBACE1BCHEOPRK1RB1
SCHEMBL20780642 0.83 ACHE (0.51) ACHEBACE1BCHEOPRK1RB1
SCHEMBL4206550 0.78 ACHE (0.58) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL12380 0.76 ACHE (0.48) ACHEBACE1BCHENPC1GAA
SCHEMBL17185176 0.75 ACHE (0.55) ACHEBACE1BCHERAB9AMEN1

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
WO-2019040106-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2019-02-28 WO disclosed