SCHEMBL31023958

SCHEMBL31023958

COc1ccc(C(c2ccc(OC)c(OC)c2)N2CCNCC2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.51
CYP19A1 P11511 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ACHE P22303 3/20 0.49
OPRD1 P41143 6/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
RAB9A P51151 1/20 0.48
P4HB P07237 2/20 0.47
SMAD3 P84022 1/20 0.46
OPRM1 P35372 2/20 0.46
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
KCNH2 Q12809 2/20 0.45
HTR7 P34969 1/20 0.45

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
SCHEMBL4709127 0.86 ACHE (0.48) CYP2D6ACHEALDH1A1TSHRRAB9A
SCHEMBL4709123 0.86 ACHE (0.48) CYP2D6ACHEALDH1A1TSHRRAB9A
SCHEMBL9186553 0.84 P4HB (0.44) CYP2D6MEN1KMT2AACHEOPRD1
SCHEMBL1980107 0.82 CYP2D6 (0.66) CYP2D6CYP19A1MEN1KMT2AOPRD1
SCHEMBL11609280 0.81 ACHE (0.77) CYP2D6MEN1KMT2AACHEALDH1A1
SCHEMBL11383249 0.81 SLC6A2 (0.49) CYP2D6ACHEALDH1A1TSHRRAB9A
Hydrochloric Acid SCHEMBL11615800 0.80 ACHE (0.75) CYP2D6MEN1KMT2AACHEALDH1A1
SCHEMBL16967417 0.80 ACHE (0.48) CYP2D6ACHEOPRD1ALDH1A1TSHR
SCHEMBL29556981 0.80 ACHE (0.48) CYP2D6ACHEOPRD1ALDH1A1TSHR
SCHEMBL8122955 0.78 OPRD1 (0.65) CYP2D6CYP19A1MEN1KMT2AOPRD1

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 CYP2D6 727/4885CYP19A1 1123/4885MEN1 740/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL CYP2D6 727/4885CYP19A1 1123/4885MEN1 740/4885

“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.