SCHEMBL31023904

SCHEMBL31023904

CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(c1ccc3c(c1)COCO3)c1ccc3c(c1)COCO3)C2

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 0.49
CYP3A4 P08684 7/20 0.45
CYP2D6 P10635 6/20 0.45
CYP2C9 P11712 6/20 0.45
CYP2C19 P33261 3/20 0.45
TSHR P16473 3/20 0.42
USP2 O75604 3/20 0.42
HIF1A Q16665 2/20 0.42
ALDH1A1 P00352 1/20 0.42
SCD5 Q86SK9 2/20 0.40
ACACB O00763 4/20 0.39
CYP1A2 P05177 1/20 0.38
GPR119 Q8TDV5 4/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL31023775 0.94 GPR183 (0.49) GPR183CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL31023896 0.93 GPR183 (0.45) GPR183CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL31023812 0.93 GPR183 (0.51) GPR183CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL31023833 0.92 GPR183 (0.48) GPR183CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL31023944 0.88 SCD5 (0.44) GPR183CYP3A4USP2ALDH1A1SCD5
SCHEMBL31023863 0.85 SCD5 (0.41) GPR183CYP3A4USP2ALDH1A1SCD5
SCHEMBL31023692 0.79 CYP3A4 (0.40) CYP3A4ALDH1A1SCD5GPR119
SCHEMBL31023744 0.78 GPR183 (0.43) GPR183ALDH1A1SCD5ACACBGPR119
SCHEMBL31023960 0.78 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9CYP2C19TSHR
SCHEMBL31023902 0.75 USP2 (0.50) CYP3A4CYP2D6CYP2C9CYP2C19TSHR

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 GPR183 2144/4885CYP3A4 2196/4885CYP2D6 727/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL GPR183 2144/4885CYP3A4 2196/4885CYP2D6 727/4885

“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.