SCHEMBL21382071

SCHEMBL21382071

Cc1ccc(C(c2ccc(F)cc2)C2CCNCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
SLC6A2 P23975 5/20 0.43
SLC6A4 P31645 5/20 0.43
SLC6A3 Q01959 4/20 0.43
OPRD1 P41143 1/20 0.43

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
SCHEMBL29734367 1.00 ACHE (0.43) ACHESLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL21382142 1.00 ACHE (0.43) ACHESLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL21382069 1.00 ACHE (0.43) ACHESLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL10459101 0.91 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL7319671 0.91 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3OPRD1
Hydrochloric Acid SCHEMBL9768345 0.90 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3OPRD1
Hydrochloric Acid SCHEMBL10459138 0.90 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3OPRD1
Trifluoroacetic Acid SCHEMBL21381807 0.88 OPRD1 (0.46) SLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL21381830 0.85 OPRD1 (0.57) SLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL21384835 0.85 OPRD1 (0.57) SLC6A2SLC6A4SLC6A3OPRD1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111936503-B Oxazine monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2023-09-12 CN disclosed
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-04-20 US disclosed
EP-3768684-B1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS HOFFMANN LA ROCHE (CH) 2023-02-22 EP disclosed
US-11420961-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2022-08-23 US disclosed
EP-3717477-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-07-20 EP disclosed
US-20210107920-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2021-04-15 US disclosed
EP-3768684-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. Hoffmann-La Roche AG (CH) 2021-01-27 EP disclosed
US-20200392125-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-12-17 US disclosed
CN-111936503-A Oxazin monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2020-11-13 CN disclosed
EP-3717477-A1 NEW HETEROCYCLIC COMPOUNDS H. Hoffnabb-La Roche Ag (CH) 2020-10-07 EP disclosed
WO-2019180185-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2019-09-26 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 (4 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-20210107920-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC ACHE 170/4885SLC6A2 4783/4885SLC6A4 4841/4885
US-11420961-B2 Heterocyclic compounds LPXN, MLX, CCNY ACHE 1188/4885SLC6A2 4377/4885SLC6A4 4397/4885
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC ACHE 170/4885SLC6A2 4783/4885SLC6A4 4841/4885
US-20200392125-A1 HETEROCYCLIC COMPOUNDS LPXN, MLX, CCNY ACHE 1188/4885SLC6A2 4377/4885SLC6A4 4397/4885

“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.