SCHEMBL31023682

SCHEMBL31023682

c1cc2c(cc1C(c1ccc3c(c1)COCO3)N1CCC3(CC1)CNC3)COCO2

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 1/20 0.37
SMAD3 P84022 7/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36
P4HB P07237 9/20 0.35
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
ADAM17 P78536 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACHE P22303 2/20 0.31
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP1A2 P05177 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
SCHEMBL31023800 0.93 CYP2D6 (0.42) USP2CYP2C9CYP2C19SMAD3ALDH1A1
SCHEMBL31023777 0.89 USP2 (0.51) USP2CYP2C9CYP2C19SMAD3ALDH1A1
SCHEMBL31023729 0.88 USP2 (0.47) USP2CYP2C9CYP2C19SMAD3ALDH1A1
SCHEMBL31023772 0.83 P4HB (0.47) SMAD3CYP2D6P4HBMEN1KMT2A
SCHEMBL31023960 0.81 CYP3A4 (0.44) USP2CYP2C9CYP2C19SMAD3ALDH1A1
SCHEMBL31023902 0.81 USP2 (0.50) USP2CYP2C9CYP2C19SMAD3ALDH1A1
SCHEMBL31023937 0.79 P4HB (0.44) SMAD3ALDH1A1CYP2D6P4HBMEN1
SCHEMBL31023968 0.75 ALDH1A1 (0.30) ALDH1A1
SCHEMBL31023723 0.74 SMAD3 (0.42) SMAD3ALDH1A1P4HBMEN1KMT2A
SCHEMBL18271347 0.68 CYP2C9 (0.73) USP2CYP2C9CYP2C19ALDH1A1CYP3A4

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 USP2 1903/4885CYP2C9 793/4885CYP2C19 435/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL USP2 1903/4885CYP2C9 793/4885CYP2C19 435/4885

“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.