SCHEMBL14647253

SCHEMBL14647253

COCC(C)(C)c1cc(NC(=O)C(C)(C)[SH](C)(=O)C2CCOCC2)on1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.68
CNR1 P21554 10/20 0.68

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
SCHEMBL14647326 0.83 CNR2 (0.61) CNR2CNR1
SCHEMBL10219942 0.81 CNR2 (1.00) CNR2CNR1
SCHEMBL12544184 0.81 CNR2 (0.69) CNR2CNR1
SCHEMBL12544338 0.78 CNR2 (1.00) CNR2CNR1
SCHEMBL1691231 0.78 CNR2 (1.00) CNR2CNR1
SCHEMBL9891529 0.77 CNR2 (0.62) CNR2CNR1
SCHEMBL14647426 0.77 CNR2 (0.67) CNR2CNR1
SCHEMBL12566542 0.76 CNR2 (0.61) CNR2CNR1
SCHEMBL14666110 0.76 CNR2 (0.70) CNR2CNR1
SCHEMBL13393064 0.75 CNR2 (0.69) 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
EP-2342200-B1 Compounds which selectively modulate the cb2 receptor BOEHRINGER INGELHEIM INT (DE) 2013-01-23 EP disclosed