SCHEMBL5199107

SCHEMBL5199107

CN(C)C(=O)Oc1cccc([C@H](CCO)OC(N)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.55
BCHE P06276 2/20 0.45
FAAH O00519 1/20 0.45

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
SCHEMBL6948132 0.85 RAB9A (0.51) ACHEBCHE
SCHEMBL5199748 0.85 RAB9A (0.51) ACHEBCHE
SCHEMBL5199101 0.82 ACHE (0.47) ACHEBCHE
SCHEMBL6950959 0.80 RAB9A (0.42) ACHEBCHE
SCHEMBL6950130 0.80 NCEH1 (0.39)
SCHEMBL28712857 0.78 TRPM8 (0.44)
SCHEMBL28712855 0.78 TRPM8 (0.44)
SCHEMBL3874325 0.77 ACHE (0.56) ACHEBCHEFAAH
SCHEMBL3865742 0.77 ACHE (0.56) ACHEBCHEFAAH
SCHEMBL5199111 0.75 NCEH1 (0.40) ACHEBCHE

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-1362844-B1 BENZYLAMINE ANALOGUE BTG INT LTD (GB) 2007-12-05 EP disclosed