SCHEMBL22488091

SCHEMBL22488091

O=C1CO[C@H]2CCN(C(=O)N3CCN(Cc4ccc(C(F)(F)F)cc4N4CCCC4)CC3)C[C@H]2N1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 9/20 0.61
▸ FAAH O00519 2/20 0.51
▸ ABHD6 Q9BV23 2/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ PLA2G7 Q13093 1/20 0.50

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
SCHEMBL27276172 1.00 MGLL (0.61) MGLLFAAHABHD6CYP2D6PLA2G7
SCHEMBL31071511 1.00 MGLL (0.61) MGLLFAAHABHD6CYP2D6PLA2G7
SCHEMBL29616461 0.89 MGLL (0.65) MGLL
SCHEMBL22462769 0.89 MGLL (0.65) MGLL
SCHEMBL24095482 0.88 MGLL (0.75) MGLL
SCHEMBL24095479 0.84 MGLL (0.61) MGLL
SCHEMBL21723274 0.84 MGLL (0.63) MGLL
SCHEMBL21730744 0.84 MGLL (0.63) MGLL
SCHEMBL21723273 0.84 MGLL (0.63) MGLL
SCHEMBL21730857 0.80 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors HOFFMANN-LA ROCHE INC. (US) 2023-10-31 — — US disclosed
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-02-16 — — US disclosed
US-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2021-09-09 — — US disclosed
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL MGLL 1/4885FAAH 48/4885ABHD6 19/4885
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, MGLL, LPL MGLL 2/4885FAAH 61/4885ABHD6 20/4885
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors LIPC, LPL, MGLL MGLL 3/4885FAAH 60/4885ABHD6 26/4885
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LPL, MGLL MGLL 3/4885FAAH 60/4885ABHD6 26/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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