SCHEMBL31023733

SCHEMBL31023733

COc1ccc(C(c2ccc3c(c2)OCCO3)N2CCN(C(=O)n3nnc4ccc(C#N)cc43)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.45
▸ FAAH O00519 4/20 0.45
▸ SMAD3 P84022 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CACNA2D1 P54289 2/20 0.37
▸ CACNA1B Q00975 2/20 0.37
▸ CACNB1 Q02641 2/20 0.37
▸ CACNA1C Q13936 2/20 0.37
▸ CACNA1G O43497 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPT P10636 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL31023930 0.94 MGLL (0.45) MGLLFAAHSMAD3MEN1KMT2A
SCHEMBL31023819 0.93 MGLL (0.49) MGLLFAAHSMAD3
SCHEMBL31023750 0.91 MGLL (0.53) MGLLFAAHMEN1KMT2ACACNA2D1
SCHEMBL31023900 0.86 MGLL (0.49) MGLLFAAHSMAD3
SCHEMBL31023792 0.84 MGLL (0.53) MGLLFAAHMEN1KMT2ACACNA2D1
SCHEMBL31023795 0.83 MGLL (0.53) MGLLFAAHCACNA2D1CACNA1BCACNB1
SCHEMBL31023917 0.83 MGLL (0.53) MGLLFAAHCACNA2D1CACNA1BCACNB1
SCHEMBL31023684 0.83 MGLL (0.60) MGLLFAAHKMT2AMAPT
SCHEMBL31023850 0.83 MGLL (0.49) MGLLFAAH
SCHEMBL31023840 0.83 MGLL (0.49) MGLLFAAH

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
EP-4665718-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF Apogee Pharmaceuticals, Inc. (CA) 2025-12-24 — — EP disclosed
US-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof APOGEE PHARMACEUTICALS, INC. (CA) 2025-08-05 — — US disclosed
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF APOGEE PHARMACEUTICALS, INC. (CA) 2024-09-05 — — US disclosed
WO-2024168426-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF APOGEE PHARMACEUTICALS, INC. (CA) 2024-08-22 — — WO 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 (2 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-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof MGLL, PNLIP, LPL MGLL 1/4885FAAH 12/4885SMAD3 4817/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL MGLL 1/4885FAAH 12/4885SMAD3 4817/4885

“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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