SCHEMBL2041920

SCHEMBL2041920

COC1=C(c2c(C)cc(C)cc2C)C(=O)C(CC2CCN(C(=O)O)CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 7/20 0.39
▸ BCHE P06276 4/20 0.39
▸ FAAH O00519 1/20 0.36
▸ ABCC4 O15439 1/20 0.36
▸ CACNA1F O60840 1/20 0.36
▸ PDE5A O76074 1/20 0.36
▸ ABCB11 O95342 1/20 0.36
▸ APP P05067 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ ABCB1 P08183 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ ADRA2A P08913 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ ADRA2C P18825 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ ADRA1A P35348 1/20 0.36

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
SCHEMBL1652641 0.89 EPHX2 (0.43) FAAHBACE1PDE4D
SCHEMBL12239386 0.81 ACHE (0.36) ACHEBCHE
SCHEMBL12239437 0.80 EPHX2 (0.42) FAAH
SCHEMBL12239445 0.80 MEN1 (0.35) ACHEBCHE
SCHEMBL1652806 0.80 TSHR (0.36) ACHEBCHE
SCHEMBL12239433 0.79 ACHE (0.36) ACHEBCHE
SCHEMBL19279416 0.78 FFAR1 (0.37) —
SCHEMBL12239434 0.78 ACHE (0.35) ACHEBCHE
SCHEMBL12239438 0.77 ACHE (0.37) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL12239440 0.76 POLB (0.34) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2512237-A2 2 -ARYL-3 -HYDROXY-CYCLOPENTENONES AS INSECTICIDES, ACARICIDES, NEMATOCIDES AND MOLLUSCICIDES Syngenta Participations AG (CH) 2012-10-24 — — EP disclosed
WO-2011073060-A2 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2011-06-23 — — WO disclosed
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