SCHEMBL19603370

SCHEMBL19603370

CCN(CC)c1cc(CNC2(C)CCN(C(=O)OC(C(F)(F)F)C(F)(F)F)CC2)ccc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.47
PLA2G7 Q13093 1/20 0.40
ABHD6 Q9BV23 1/20 0.40

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
SCHEMBL20778366 0.78 ABHD6 (0.48) MGLLPLA2G7ABHD6
SCHEMBL19603375 0.75 TACR1 (0.34)
SCHEMBL20570228 0.74 TACR1 (0.45)
SCHEMBL30458103 0.74 TACR1 (0.45)
SCHEMBL19603186 0.72 MGLL (0.38) MGLL
SCHEMBL19603288 0.69 MGLL (0.69) MGLL
SCHEMBL19603354 0.68 MGLL (0.61) MGLLPLA2G7ABHD6
SCHEMBL19603184 0.68 MGLL (0.57) MGLLPLA2G7ABHD6
SCHEMBL20769548 0.68 MGLL (0.51) MGLLABHD6
SCHEMBL19603236 0.67 MGLL (0.57) MGLLPLA2G7ABHD6

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
WO-2017197192-A1 SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2017-11-16 WO disclosed