SCHEMBL20399809

SCHEMBL20399809

O=C(O)N1CCC2(C=C(OS(=O)(=O)C(F)(F)F)CCO2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 3/20 0.32

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
SCHEMBL3346542 0.88 MGLL (0.33) MGLL
SCHEMBL20395925 0.87 USP2 (0.39) —
SCHEMBL2422488 0.74 RORC (0.41) —
SCHEMBL18812823 0.72 BACE1 (0.35) MGLL
SCHEMBL7700874 0.72 HSD11B1 (0.31) —
SCHEMBL2422490 0.71 DRD2 (0.31) —
SCHEMBL308840 0.71 BACE1 (0.30) —
SCHEMBL18153985 0.70 BACE1 (0.30) —
SCHEMBL31570420 0.70 — —
SCHEMBL12481520 0.69 OPRD1 (0.39) MGLL

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-2018134695-A1 1,1,1-TRIFLUORO-3-HYDROXYPROPAN-2-YL CARBAMATE DERIVATIVES AS MAGL INHIBITORS PFIZER INC. (US) 2018-07-26 — — WO disclosed
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