SCHEMBL31023906

SCHEMBL31023906

O=C(Oc1c(F)c(F)c(F)c(F)c1F)C1CCN(C(c2ccc3c(c2)COCO3)c2ccc3c(c2)COCO3)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.36
KDM4D Q6B0I6 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMAD3 P84022 4/20 0.35
NR3C1 P04150 1/20 0.35
P4HB P07237 5/20 0.34
POLB P06746 1/20 0.34
ACHE P22303 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL31023932 0.87 NPC1 (0.47) MGLLNPC1RAB9ASMAD3P4HB
SCHEMBL31023825 0.84 MGLL (0.40) MGLLSMAD3NR3C1ACHEMAPT
SCHEMBL31023687 0.82 MGLL (0.42) MGLLKDM4DNPC1RAB9ASMAD3
SCHEMBL31023769 0.82 SMAD3 (0.41) SMAD3P4HBALDH1A1TSHR
SCHEMBL31023753 0.82 SMAD3 (0.41) SMAD3P4HBALDH1A1TSHR
SCHEMBL31023970 0.73 MGLL (0.55) MGLLSMAD3NR3C1P4HBACHE
SCHEMBL31023723 0.73 SMAD3 (0.42) MGLLSMAD3P4HBALDH1A1MAPT
SCHEMBL31023944 0.71 SCD5 (0.44) MGLLNPC1RAB9ASMAD3NR3C1
SCHEMBL31023940 0.70 HPGD (0.52) NPC1RAB9ASMAD3P4HBALDH1A1
SCHEMBL31023772 0.70 P4HB (0.47) SMAD3P4HB

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 1/4885KDM4D 3821/4885NPC1 602/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL MGLL 1/4885KDM4D 3821/4885NPC1 602/4885

“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.