SCHEMBL20198161

SCHEMBL20198161

Cc1ccc(C(c2ccc(Br)cc2)N2CCN(C(=O)OC(C(F)(F)F)C(F)(F)F)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 14/20 0.69
MGLL Q99685 9/20 0.69
PLA2G7 Q13093 5/20 0.57
CACNA2D1 P54289 1/20 0.46
CACNA1B Q00975 1/20 0.46
CACNB1 Q02641 1/20 0.46
CACNA1C Q13936 1/20 0.46

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
SCHEMBL15100761 0.94 ABHD6 (0.77) ABHD6MGLLPLA2G7
SCHEMBL20408675 0.84 MGLL (0.59) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL15100763 0.83 MGLL (0.79) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL26079559 0.82 MGLL (0.57) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL21868779 0.82 CACNA2D1 (0.48) ABHD6MGLLCACNA2D1CACNA1BCACNB1
SCHEMBL15100884 0.82 MGLL (1.00) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL16744460 0.81 MGLL (0.76) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL22365053 0.76 MGLL (0.68) ABHD6MGLLPLA2G7CACNA2D1CACNA1B
SCHEMBL16744475 0.76 ABHD6 (0.56) ABHD6MGLLPLA2G7
SCHEMBL15101001 0.76 CNR1 (0.49) ABHD6MGLL

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-3326627-A1 CARBAMATE COMPOUNDS AND OF MAKING AND USING SAME Abide Therapeutics, Inc. (US) 2018-05-30 EP disclosed