SCHEMBL29734416

SCHEMBL29734416

COc1ccc(C(=C2CCN(C(=O)OC(C)(C)C)CC2)c2ccncc2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.50
▸ PDE4B Q07343 4/20 0.48
▸ PDE4A P27815 3/20 0.48
▸ PDE4C Q08493 3/20 0.48
▸ PDE4D Q08499 3/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ CFTR P13569 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GPR119 Q8TDV5 4/20 0.44
▸ PKM P14618 1/20 0.43
▸ SMPD3 Q9NY59 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL22491440 1.00 LMNA (0.50) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL30567965 0.88 POLB (0.46) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL23211806 0.88 POLB (0.46) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL30149847 0.88 POLB (0.46) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL21381837 0.85 LMNA (0.55) LMNAPDE4BMEN1KMT2AALDH1A1
SCHEMBL22491587 0.84 PTAFR (0.51) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL29734522 0.84 PTAFR (0.51) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL30567986 0.78 GPR119 (0.51) GPR119
SCHEMBL23211871 0.78 GPR119 (0.51) GPR119
SCHEMBL22773311 0.78 MEN1 (0.42) MEN1KMT2APOLBGPR119PKM

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 4 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-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

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-11420961-B2 Heterocyclic compounds LPXN, MLX, CCNY LMNA 16/4885PDE4B 1803/4885PDE4A 2507/4885
US-20230117324-A1 OXAZINE MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS MGLL, LPL, LIPC LMNA 381/4885PDE4B 1379/4885PDE4A 1174/4885

“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.

Send feedback