SCHEMBL31023706

SCHEMBL31023706

c1cc2c(cc1C(=C1CCCNCC1)c1ccc3c(c1)COCO3)COCO2

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 12/20 0.33
▸ OPRM1 P35372 11/20 0.33
▸ OPRK1 P41145 4/20 0.33
▸ ABCB11 O95342 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ MGLL Q99685 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ AR P10275 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ SLC5A2 P31639 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
SCHEMBL31023918 0.95 OPRD1 (0.36) OPRD1OPRM1OPRK1ABCB11KCNH2
SCHEMBL31023895 0.78 ALDH1A1 (0.42) OPRD1OPRM1OPRK1ABCB11KCNH2
SCHEMBL15100886 0.76 ALDH1A1 (0.50) MGLL
SCHEMBL31023883 0.75 ALDH1A1 (0.32) PRKCISLC5A2
SCHEMBL31023806 0.75 SLC5A2 (0.30) PRKCISLC5A2
SCHEMBL31023911 0.73 OPRM1 (0.38) OPRD1OPRM1PRKCISLC5A2
SCHEMBL31023851 0.70 ALDH1A1 (0.41) MGLLCHRM2
SCHEMBL31023870 0.70 SRD5A2 (0.51) PRKCI
SCHEMBL3456941 0.67 KDM4E (0.53) —
SCHEMBL3642753 0.67 TSHR (0.53) PRKCI

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 OPRD1 1514/4885OPRM1 810/4885OPRK1 1501/4885
US-20240294514-A1 SMALL MOLECULES AS MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS, COMPOSITIONS AND USE THEREOF MGLL, PNLIP, LPL OPRD1 1514/4885OPRM1 810/4885OPRK1 1501/4885

“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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