SCHEMBL31023703

SCHEMBL31023703

N#Cc1ncn(C(=O)N2CC3(CCN(C(c4ccc5c(c4)COCO5)c4ccc5c(c4)COCO5)C3)C2)n1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 9/20 0.33
▸ CYP2D6 P10635 9/20 0.33
▸ TSHR P16473 8/20 0.33
▸ CYP3A4 P08684 8/20 0.33
▸ USP2 O75604 7/20 0.33
▸ CYP2C9 P11712 4/20 0.33
▸ CYP2C19 P33261 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ RECQL P46063 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL31023955 0.96 CYP2D6 (0.34) CYP1A2CYP2D6TSHRCYP3A4USP2
SCHEMBL31023898 0.96 CYP1A2 (0.32) CYP1A2CYP2D6TSHRCYP3A4USP2
SCHEMBL31023893 0.96 CYP1A2 (0.32) CYP1A2CYP2D6TSHRCYP3A4USP2
SCHEMBL31023873 0.93 — —
SCHEMBL31023638 0.93 CYP3A4 (0.34) CYP1A2CYP2D6TSHRCYP3A4USP2
SCHEMBL31023818 0.92 CYP2D6 (0.33) CYP1A2CYP2D6TSHRCYP3A4USP2
SCHEMBL31023760 0.87 MGLL (0.36) ALDH1A1KMT2A
SCHEMBL31023640 0.84 FAAH (0.37) —
SCHEMBL31023830 0.83 FAAH (0.31) —
SCHEMBL31023785 0.79 MGLL (0.51) —

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12378231-B2 Small molecules as monoacylglycerol lipase (MAGL) inhibitors, compositions and use thereof APOGEE PHARMACEUTICALS, INC. (CA) 2025-08-05 — — US claimed
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 CYP1A2 756/4885CYP2D6 727/4885TSHR 4582/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL CYP1A2 756/4885CYP2D6 727/4885TSHR 4582/4885

“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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