SCHEMBL21381971

SCHEMBL21381971

OB(O)c1ccc(OC(F)(F)F)c(Br)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
TSHR P16473 1/20 0.38
ABL1 P00519 1/20 0.36
EPHX2 P34913 2/20 0.35
PDE2A O00408 1/20 0.33
MBOAT4 Q96T53 1/20 0.32
ENPP2 Q13822 3/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TTR P02766 1/20 0.31

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
SCHEMBL20371228 0.82 CA2 (0.38) MGLLCA1CA2TSHRENPP2
SCHEMBL491621 0.80 EPHX2 (0.50) MGLLCA1CA2ABL1EPHX2
SCHEMBL29953648 0.80 MGLL (0.39) MGLLCA1CA2ABL1EPHX2
SCHEMBL641972 0.79 SCN5A (0.39) MGLLCA1CA2ABL1EPHX2
SCHEMBL508251 0.79 TTR (0.46) MGLLABL1ENPP2TTR
SCHEMBL26998944 0.78 KMO (0.39) MGLLABL1EPHX2ALDH1A1
SCHEMBL29953216 0.77 ENPP2 (0.41) MGLLCA1CA2ABL1PDE2A
SCHEMBL20638904 0.77 ENPP2 (0.41) MGLLCA1CA2TSHRABL1
SCHEMBL22683815 0.76 APP (0.45) MGLLCA1CA2ABL1ENPP2
SCHEMBL1496432 0.76 MGLL (0.39) MGLLCA1CA2ABL1EPHX2

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 7 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-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
CN-111936503-A Oxazin monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2020-11-13 CN 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 (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-20210107920-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC MGLL 1/4885CA1 4330/4885CA2 4129/4885
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC MGLL 1/4885CA1 4330/4885CA2 4129/4885

“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.