SCHEMBL31023956

SCHEMBL31023956

COc1cccc(C(c2cccc(OC)c2)N2CCN(C(=O)n3cnc(C#N)n3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 4/20 0.45
▸ USP2 O75604 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ CACNA2D1 P54289 3/20 0.43
▸ CACNA1B Q00975 3/20 0.43
▸ CACNB1 Q02641 3/20 0.43
▸ OPRD1 P41143 2/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ FAAH O00519 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CACNA1C Q13936 2/20 0.40
▸ ROCK2 O75116 1/20 0.40
▸ CACNA1G O43497 1/20 0.40

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
SCHEMBL31023788 0.88 CACNA2D1 (0.47) MGLLUSP2ALDH1A1LMNANPSR1
SCHEMBL31023698 0.83 MGLL (0.49) MGLLALDH1A1CACNA2D1CACNA1BCACNB1
SCHEMBL31023782 0.81 MGLL (0.39) MGLLNPSR1CACNA2D1CACNA1BCACNB1
SCHEMBL31023913 0.79 MGLL (0.46) MGLLALDH1A1NPSR1OPRD1OPRM1
SCHEMBL31023841 0.77 FAAH (0.39) MGLLALDH1A1NPSR1MAPTFAAH
SCHEMBL31023919 0.76 MGLL (0.54) MGLLFAAH
SCHEMBL31023764 0.76 MGLL (0.38) MGLLUSP2ALDH1A1LMNANPSR1
SCHEMBL31023814 0.75 OGA (0.40) MGLLALDH1A1NPSR1MAPTFAAH
SCHEMBL31023874 0.74 MGLL (0.44) MGLLUSP2ALDH1A1NPSR1CACNA2D1
SCHEMBL31023760 0.74 MGLL (0.36) MGLLALDH1A1NPSR1MAPTFAAH

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 1/4885USP2 1903/4885ALDH1A1 530/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL MGLL 1/4885USP2 1903/4885ALDH1A1 530/4885

“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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