SCHEMBL9264261

SCHEMBL9264261

Cc1ccc(S(=O)(=O)Oc2ccc3c(c2)cc2n3CC(CC3CCN(Cc4ccccc4)CC3)C2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.42
ACHE P22303 5/20 0.41
BCHE P06276 4/20 0.41
MAOB P27338 2/20 0.41
FAAH O00519 1/20 0.41
ABCC4 O15439 1/20 0.41
CACNA1F O60840 1/20 0.41
PDE5A O76074 1/20 0.41
ABCB11 O95342 1/20 0.41
APP P05067 1/20 0.41
CHRM2 P08172 1/20 0.41
ABCB1 P08183 1/20 0.41
CYP3A4 P08684 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
CHRM1 P11229 1/20 0.41
ADRA2C P18825 1/20 0.41
DRD4 P21917 1/20 0.41
SLC6A2 P23975 1/20 0.41
AGTR1 P30556 1/20 0.41

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
SCHEMBL9258002 0.85 BCHE (0.47) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9258180 0.85 ACHE (0.52) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9257794 0.83 MAOA (0.49) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9259703 0.82 NPC1 (0.46) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9265528 0.82 ACHE (0.44) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9258300 0.80 BCHE (0.47) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9264491 0.80 ACHE (0.47) ACHEBACE1SMN1; SMN2
SCHEMBL9264496 0.80 ACHE (0.47) ACHEBACE1SMN1; SMN2
SCHEMBL9264946 0.79 ACHE (0.48) ACHEBCHEMAOBFAAHABCC4
SCHEMBL9256301 0.78 HTR2B (0.45) ACHEBCHEMAOBFAAHABCC4

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
US-5428043-A Tricyclic-cyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1995-06-27 US claimed
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP claimed
US-5428043-A Tricyclic-cyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1995-06-27 US disclosed
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed