SCHEMBL31023750

SCHEMBL31023750

COc1ccc(C(c2ccc(OC)cc2)N2CCN(C(=O)n3nnc4ccc(C#N)cc43)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 7/20 0.53
▸ FAAH O00519 4/20 0.53
▸ CACNA2D1 P54289 3/20 0.43
▸ CACNB1 Q02641 3/20 0.43
▸ CACNA1B Q00975 2/20 0.43
▸ CACNA1C Q13936 2/20 0.43
▸ CACNA1G O43497 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ CACNA1A O00555 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC10 Q969S8 1/20 0.38
▸ HDAC11 Q96DB2 1/20 0.38

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
SCHEMBL31023792 0.93 MGLL (0.53) MGLLFAAHCACNA2D1CACNB1CACNA1B
SCHEMBL31023917 0.92 MGLL (0.53) MGLLFAAHCACNA2D1CACNB1CACNA1B
SCHEMBL31023684 0.91 MGLL (0.60) MGLLFAAHKMT2AKDM4EMAPT
SCHEMBL31023733 0.91 MGLL (0.45) MGLLFAAHCACNA2D1CACNB1CACNA1B
SCHEMBL31023795 0.90 MGLL (0.53) MGLLFAAHCACNA2D1CACNB1CACNA1B
SCHEMBL31023840 0.89 MGLL (0.49) MGLLFAAHKDM4EALDH1A1
SCHEMBL31023850 0.89 MGLL (0.49) MGLLFAAHKDM4EALDH1A1
SCHEMBL31023817 0.88 MGLL (0.51) MGLLFAAHCACNA2D1CACNB1CACNA1B
SCHEMBL31023789 0.87 MGLL (0.48) MGLLFAAH
SCHEMBL31023838 0.83 MGLL (0.60) MGLLFAAHKMT2AKDM4EMAPT

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 12/4885CACNA2D1 952/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL MGLL 1/4885FAAH 12/4885CACNA2D1 952/4885

“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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