SCHEMBL4390417

SCHEMBL4390417

CC(C)(C)OC(=O)N1CCN(CCNc2ccncc2)C(=O)C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
GPR119 Q8TDV5 8/20 0.42
MAPT P10636 1/20 0.40
PRKCI P41743 1/20 0.40
NR1H2 P55055 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
ACKR3 P25106 1/20 0.38
BUB1 O43683 1/20 0.38
MAPK1 P28482 1/20 0.38
ACHE P22303 1/20 0.38
USP30 Q70CQ3 1/20 0.38

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
SCHEMBL4387840 0.89 JAK2 (0.43) KEAP1NFE2L2GPR119MAPTNR1H2
SCHEMBL12311345 0.89 GPR119 (0.43) GPR119MAPTNR1H2ACKR3MAPK1
SCHEMBL4388222 0.80 GPR119 (0.41) GPR119MAPTNR1H2MAPK1
SCHEMBL28437919 0.78 NR1H2 (0.43) GPR119MAPTNR1H2MAPK1
SCHEMBL4391251 0.77 ACKR3 (0.38) NR1H2ACKR3ACHE
SCHEMBL1176507 0.77 NR1H2 (0.40) MAPTNR1H2MAPK1
SCHEMBL4005175 0.76 NR1H2 (0.41) MAPTNR1H2MAPK1
SCHEMBL1583253 0.76 P2RX7 (0.46) MAPTNR1H2MAPK1
SCHEMBL6535858 0.75 GPR119 (0.57) KEAP1NFE2L2GPR119
SCHEMBL24744821 0.75 NR1H2 (0.40) MAPTNR1H2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 EP disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
WO-2000032590-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-08 WO disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 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 (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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 KEAP1 1607/4885NFE2L2 301/4885GPR119 3346/4885

“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.