SCHEMBL6989427

SCHEMBL6989427

CC(C)(C)OC(=O)N1CCC(CCc2noc3cc4c(cc23)CC(=O)N4)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 11/20 0.62
▸ BCHE P06276 8/20 0.62
▸ CRBN Q96SW2 2/20 0.43
▸ FAAH O00519 1/20 0.41
▸ GRIA1 P42261 2/20 0.41
▸ GPR119 Q8TDV5 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ DDB1 Q16531 1/20 0.38

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
SCHEMBL6848280 0.91 ACHE (0.64) ACHEBCHE
SCHEMBL6986573 0.88 ACHE (0.72) ACHEBCHE
SCHEMBL6989899 0.84 ACHE (0.72) ACHEBCHE
SCHEMBL7672658 0.83 ACHE (0.65) ACHEBCHE
SCHEMBL7674312 0.81 ACHE (0.71) ACHEBCHE
SCHEMBL6991285 0.81 ACHE (0.63) ACHEBCHECRBNFAAHGPR119
Icopezil SCHEMBL194482 0.77 ACHE (1.00) ACHEBCHE
Icopezil SCHEMBL2231222 0.76 ACHE (1.00) ACHEBCHE
SCHEMBL4126446 0.75 ACHE (0.43) ACHEBCHEFAAHGPR119
SCHEMBL13596543 0.73 ACHE (0.42) ACHEBCHEFAAHGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0646115-B1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES EISAI CO LTD (JP) 2003-01-22 — — EP disclosed
EP-1048302-A2 Radiotracers for in vivo study of acetylcholinesterase and Alzheimer's disease Pfizer Products Inc. (US) 2000-11-02 — — EP disclosed
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