SCHEMBL20503573

SCHEMBL20503573

CC(=O)Nc1ccn(C(=O)N2CCN(Cc3ccc(Cl)cc3N3CCN(C[SH](=O)=O)CC3)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 11/20 0.47
FAAH O00519 8/20 0.47
ABHD6 Q9BV23 4/20 0.41
PLA2G7 Q13093 3/20 0.41

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
SCHEMBL20503557 0.91 MGLL (0.49) MGLLFAAHABHD6PLA2G7
SCHEMBL20503539 0.91 MGLL (0.49) MGLLFAAHABHD6PLA2G7
SCHEMBL20503579 0.90 MGLL (0.56) MGLLFAAHABHD6PLA2G7
SCHEMBL20503618 0.90 MGLL (0.56) MGLLFAAHABHD6PLA2G7
SCHEMBL20503742 0.88 FAAH (0.55) MGLLFAAHABHD6PLA2G7
SCHEMBL20503510 0.87 MGLL (0.46) MGLLFAAHABHD6PLA2G7
SCHEMBL20503520 0.87 MGLL (0.46) MGLLFAAHABHD6PLA2G7
SCHEMBL20503559 0.87 MGLL (0.54) MGLLFAAHABHD6PLA2G7
SCHEMBL20503627 0.86 MGLL (0.51) MGLLFAAHABHD6PLA2G7
SCHEMBL21271234 0.86 MGLL (0.48) MGLLFAAHABHD6PLA2G7

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-3377060-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME Abide Therapeutics, Inc. (US) 2018-09-26 EP disclosed