SCHEMBL21381608

SCHEMBL21381608

CS(=O)(=O)c1cccc(C(=C2CCN(C(=O)O)CC2)c2ccncc2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.50
▸ FNTB P49356 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KRAS P01116 1/20 0.39
▸ SETD7 Q8WTS6 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ VNN1 O95497 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ NAMPT P43490 1/20 0.38
▸ BRAF P15056 1/20 0.37
▸ CSNK2A2 P19784 1/20 0.37
▸ CSNK2B P67870 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.37

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
SCHEMBL22491504 0.92 SETD7 (0.47) FNTAFNTBKRASSETD7ALDH1A1
SCHEMBL21381728 0.89 VNN1 (0.46) FNTAFNTBALDH1A1VNN1BRAF
SCHEMBL23211871 0.85 GPR119 (0.51) FNTAFNTB
SCHEMBL30567986 0.85 GPR119 (0.51) FNTAFNTB
SCHEMBL22773331 0.80 SETD7 (0.50) FNTAFNTBSETD7AKR1C3AKR1C1
SCHEMBL22491548 0.78 GPR119 (0.54) —
SCHEMBL29734566 0.78 GPR119 (0.54) —
SCHEMBL23212048 0.75 GPR119 (0.49) VNN1BRAF
SCHEMBL30149843 0.75 GPR119 (0.49) VNN1BRAF
SCHEMBL30568010 0.75 GPR119 (0.49) VNN1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 FNTA 2399/4885FNTB 2581/4885L3MBTL1 424/4885
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC FNTA 2399/4885FNTB 2581/4885L3MBTL1 424/4885

“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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