SCHEMBL6522277

SCHEMBL6522277

CC(C)(C)OC(=O)N1CCC(CON2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
PKM P14618 1/20 0.54
GPR119 Q8TDV5 11/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.46
STS P08842 1/20 0.46
TGFBR1 P36897 1/20 0.45

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
SCHEMBL31314345 0.93 KDM4E (0.49) KDM4EPKMGPR119L3MBTL1TP53
SCHEMBL31314168 0.93 KDM4E (0.49) KDM4EPKMGPR119L3MBTL1TP53
SCHEMBL30503497 0.91 KDM4E (0.54) KDM4EPKMGPR119L3MBTL1TP53
SCHEMBL754711 0.91 KDM4E (0.54) KDM4EPKMGPR119L3MBTL1TP53
SCHEMBL24742264 0.88 NAMPT (0.50) KDM4EPKMGPR119
SCHEMBL31314279 0.88 NAMPT (0.50) KDM4EPKMGPR119
SCHEMBL9668952 0.86 ACKR3 (0.49) KDM4EPKM
SCHEMBL21911480 0.83 KDM4E (0.49) KDM4EPKMGPR119
SCHEMBL12635860 0.83 KDM4E (0.56) KDM4EPKMGPR119L3MBTL1TP53
SCHEMBL15208916 0.83 PRMT5 (0.48) KDM4EPKMGPR119L3MBTL1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200102331-A1 PENICILLIN-BINDING PROTEIN INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-04-02 US disclosed
US-8507676-B2 Heterocyclic oxime compounds NOVARTIS AG (CH) 2013-08-13 US disclosed
US-8507676-B2 Heterocyclic oxime compounds NOVARTIS AG (CH) 2013-08-13 US disclosed
US-8410264-B2 Heterocyclic oxime compounds NOVARTIS AG (CH) 2013-04-02 US disclosed
US-8410264-B2 Heterocyclic oxime compounds NOVARTIS AG (CH) 2013-04-02 US disclosed
US-20120302570-A1 HETEROCYCLIC OXIME COMPOUNDS NOVARTIS AG (CH) 2012-11-29 US disclosed
US-20120302570-A1 HETEROCYCLIC OXIME COMPOUNDS NOVARTIS AG (CH) 2012-11-29 US disclosed
US-20110065708-A1 HETEROCYCLIC OXIME COMPOUNDS NOVARTIS AG (CH) 2011-03-17 US disclosed
US-20110065708-A1 HETEROCYCLIC OXIME COMPOUNDS NOVARTIS AG (CH) 2011-03-17 US disclosed
WO-2011020861-A1 HETEROCYCLIC OXIME COMPOUNDS NOVARTIS AG (CH) 2011-02-24 WO disclosed
EP-0495750-A2 Heterocyclic hydroxylamine CIBA-GEIGY AG (CH) 1992-07-22 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 (3 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-20200102331-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL KDM4E 2087/4885PKM 3124/4885GPR119 3556/4885
US-20110065708-A1 HETEROCYCLIC OXIME COMPOUNDS MET, ERBB2, TIE1 KDM4E 684/4885PKM 179/4885GPR119 173/4885
US-20120302570-A1 HETEROCYCLIC OXIME COMPOUNDS MET, ERBB2, TIE1 KDM4E 684/4885PKM 179/4885GPR119 173/4885

“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.