SCHEMBL21061733

SCHEMBL21061733

O=C1COc2ccc(C(=O)N3CCC(F)(Cc4ccc(Cl)cc4)CC3)cc2N1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ MGLL Q99685 1/20 0.52
▸ MAPT P10636 1/20 0.50
▸ DRD4 P21917 1/20 0.49
▸ NR3C2 P08235 10/20 0.49
▸ NR3C1 P04150 5/20 0.49
▸ PARP1 P09874 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL30541689 1.00 ALDH1A1 (0.54) ALDH1A1KDM4EMGLLMAPTDRD4
SCHEMBL21061734 0.82 MGLL (0.62) ALDH1A1KDM4EMGLLMAPTDRD4
SCHEMBL30541705 0.82 MGLL (0.62) ALDH1A1KDM4EMGLLMAPTDRD4
SCHEMBL21097701 0.79 NR3C2 (0.54) ALDH1A1MGLLMAPTDRD4NR3C2
SCHEMBL30541701 0.79 NR3C2 (0.54) ALDH1A1MGLLMAPTDRD4NR3C2
SCHEMBL19833935 0.78 MGLL (0.73) ALDH1A1MGLLMAPTNR3C2NR3C1
SCHEMBL22491427 0.77 ALDH1A1 (0.54) ALDH1A1MGLLMAPTDRD4NR3C2
SCHEMBL14072961 0.77 NR3C2 (0.61) ALDH1A1MGLLMAPTNR3C2NR3C1
SCHEMBL4287057 0.76 ALDH1A1 (0.78) ALDH1A1KDM4EMAPTDRD4PARP1
SCHEMBL532062 0.76 NR3C2 (0.61) ALDH1A1MGLLMAPTNR3C2NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183224-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-06-15 — — US claimed
US-20200308158-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 — — US claimed
US-20230183224-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-06-15 — — US disclosed
US-20230183224-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-06-15 — — US disclosed
EP-3724186-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2020-10-21 — — EP disclosed
US-20200308158-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 — — US disclosed
US-20200308158-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 — — US disclosed
WO-2019115660-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2019-06-20 — — WO disclosed
WO-2019115660-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2019-06-20 — — 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-20230183224-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, LIPC, PNLIP ALDH1A1 800/4885KDM4E 1260/4885MGLL 4/4885
US-20200308158-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, LIPC, PNLIP ALDH1A1 800/4885KDM4E 1260/4885MGLL 4/4885

“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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