SCHEMBL21730652

SCHEMBL21730652

O=C1COC2CCN(C(=O)N3CC(OCc4ccc(C(F)(F)F)cc4Cl)C3)C[C@H]2N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 12/20 0.72

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
SCHEMBL23150535 1.00 MGLL (0.72) MGLL
SCHEMBL21723746 1.00 MGLL (0.72) MGLL
SCHEMBL23150534 1.00 MGLL (0.72) MGLL
SCHEMBL23176601 1.00 MGLL (0.72) MGLL
SCHEMBL23148888 0.95 MGLL (0.69) MGLL
SCHEMBL29616634 0.92 MGLL (0.67) MGLL
SCHEMBL22488645 0.92 MGLL (0.67) MGLL
SCHEMBL31071596 0.92 MGLL (0.67) MGLL
SCHEMBL23176453 0.91 MGLL (0.75) MGLL
SCHEMBL23152344 0.91 MGLL (0.75) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020035425-A1 NEW HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2020-02-20 — — WO disclosed
WO-2020035424-A1 NEW HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2020-02-20 — — WO disclosed
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