SCHEMBL9547666

SCHEMBL9547666

CC(=O)OC1CCc2nc3ccccc3c(N)c2C1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.62
TSHR P16473 3/20 0.50
HSD17B10 Q99714 3/20 0.50
TP53 P04637 1/20 0.50
BCHE P06276 5/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CACNB4 O00305 1/20 0.49
CACNA1A O00555 1/20 0.49
SLC22A2 O15244 1/20 0.49
SLC22A1 O15245 1/20 0.49
ABCC4 O15439 1/20 0.49
CACNA1G O43497 1/20 0.49
CACNG3 O60359 1/20 0.49
CACNA1F O60840 1/20 0.49
CACNA1H O95180 1/20 0.49
APP P05067 1/20 0.49
FABP1 P07148 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
SCHEMBL9547682 0.87 ACHE (0.58) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547686 0.86 ACHE (0.57) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547684 0.84 ACHE (0.54) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547673 0.83 ACHE (0.53) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547695 0.82 ACHE (0.52) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547691 0.82 ACHE (0.52) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547688 0.82 ACHE (0.52) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547712 0.82 ACHE (0.52) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547704 0.82 ACHE (0.52) ACHETSHRHSD17B10TP53BCHE
SCHEMBL9547699 0.77 ACHE (0.60) ACHETSHRHSD17B10BCHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0369388-B1 HYDROXY-1,2,3,4-TETRAHYDROAMINOACRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-19 EP claimed
EP-0369388-A1 Hydroxy-1,2,3,4-tetrahydroaminoacridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-05-23 EP claimed
EP-0369388-B1 HYDROXY-1,2,3,4-TETRAHYDROAMINOACRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-19 EP disclosed
EP-0369388-A1 Hydroxy-1,2,3,4-tetrahydroaminoacridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-05-23 EP disclosed