SCHEMBL21098291

SCHEMBL21098291

O=C1COc2ccc(C(=O)N3CCC(Cc4ccccc4)C3)cc2N1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.55
NR3C2 P08235 5/20 0.52
USP30 Q70CQ3 1/20 0.51
GAA P10253 2/20 0.50
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
GRIN1 Q05586 1/20 0.48
PARP1 P09874 1/20 0.48
TACR3 P29371 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47

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
SCHEMBL30541690 1.00 MGLL (0.55) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL30541708 0.94 MGLL (0.59) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL21061872 0.94 MGLL (0.59) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL21098292 0.88 MGLL (0.53) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL30541706 0.88 MGLL (0.53) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL21061963 0.88 MGLL (0.51) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL30541694 0.88 MGLL (0.51) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL21098096 0.86 MGLL (0.57) MGLLNR3C2USP30GAAALDH1A1
SCHEMBL21061736 0.84 MGLL (0.67) MGLLNR3C2GRIN1
SCHEMBL21061734 0.84 MGLL (0.62) MGLLNR3C2USP30GAAALDH1A1

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
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
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

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 MGLL 4/4885NR3C2 2686/4885USP30 682/4885
US-20200308158-A1 BEZOXAZINE DERIVATIVES USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS LPL, LIPC, PNLIP MGLL 4/4885NR3C2 2686/4885USP30 682/4885

“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.