SCHEMBL6802352

SCHEMBL6802352

CC(C)(C)OC(=O)N1CC[C@H](OC(=O)c2ccc([N+](=O)[O-])cc2)C1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
ALDH1A1 P00352 3/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
PTPN2 P17706 1/20 0.52
PTPN1 P18031 1/20 0.52
GPR119 Q8TDV5 7/20 0.48
HTT P42858 1/20 0.47
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.44
USP30 Q70CQ3 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43

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
SCHEMBL6802356 1.00 MAPT (0.59) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL30565801 0.93 ALDH1A1 (0.57) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL735702 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL1556545 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL735703 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL2923449 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL2923456 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL1556541 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL735704 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL2923452 0.87 MAPT (0.54) MAPTALDH1A1LMNAPOLBSMN1; SMN2

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
EP-1475373-A1 5,11-Dihydrodibenzo[b,e][1,4]-oxazepine derivatives as calcium channel antagonists Ajinomoto Co., Inc. (JP) 2004-11-10 EP disclosed
EP-1471060-A1 5,11-Dihydrodibenzo[b,e][1,4]-oxazepine derivatives as calcium channel antagonists Ajinomoto Co., Inc. (JP) 2004-10-27 EP disclosed
US-6528504-B2 Compounds such as (R)-5,11-dihydro-5-(1-(4-methoxyphenethyl)-piperidine-2-ylmethyl) -dibenzo(b,e)(1,4) oxazepine are useful for treating or preventing abnormal motor functions of gastrointestinal tracts, e.g., irritable bowel syndrome. AJINOMOTO CO., INC. (JP) 2003-03-04 US disclosed
US-20020099047-A1 Oxazepine derivatives and medicine containing the same AJINOMOTO CO., INC. (JP) 2002-07-25 US disclosed
EP-1142884-A1 OXAZEPINE DERIVATIVES AND DRUGS CONTAINING THE SAME Ajinomoto Co., Inc. (JP) 2001-10-10 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 (1 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-20020099047-A1 Oxazepine derivatives and medicine containing the same CACNG5, GRIK5, KCNB1 MAPT 3887/4885ALDH1A1 695/4885LMNA 3631/4885

“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.