SCHEMBL27938510

SCHEMBL27938510

CC(=O)Oc1ccc(NC2CC2)c(OCC2CC2)n1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 13/20 0.57
▸ CNR1 P21554 2/20 0.53
▸ LRRK2 Q5S007 4/20 0.37
▸ ACACB O00763 1/20 0.36
▸ CYP4F2 P78329 1/20 0.35
▸ CYP4A11 Q02928 1/20 0.35

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
SCHEMBL17763937 0.82 CNR2 (0.71) CNR2CNR1
SCHEMBL17763851 0.81 CNR2 (0.72) CNR2CNR1
SCHEMBL17763930 0.81 CNR2 (0.74) CNR2CNR1
SCHEMBL14152486 0.79 CNR2 (0.67) CNR2CNR1
SCHEMBL14151449 0.79 CNR2 (0.67) CNR2CNR1
SCHEMBL14226272 0.73 CNR2 (1.00) CNR2CNR1
SCHEMBL28031716 0.72 CNR2 (0.37) CNR2CNR1
SCHEMBL28809495 0.71 CNR2 (0.36) CNR2CNR1
SCHEMBL27938623 0.71 CNR2 (0.35) CNR2CNR1LRRK2
SCHEMBL28031676 0.71 CNR2 (0.53) CNR2CNR1

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
CN-103608332-A Pyridine-2-amides useful as CB2 agonists HOFFMANN LA ROCHE 2014-02-26 — — CN disclosed
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