SCHEMBL5364042

SCHEMBL5364042

CCC(C)(C)C(=O)C(=O)N1CCCN1C(=O)OCCCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 14/20 0.62
MTOR P42345 1/20 0.49
FKBP4 Q02790 1/20 0.49
FKBP5 Q13451 1/20 0.49
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5368168 0.98 FKBP1A (0.64) FKBP1AMTORFKBP4FKBP5ALDH1A1
SCHEMBL5375908 0.97 FKBP1A (0.58) FKBP1AMTORFKBP4FKBP5
SCHEMBL5364216 0.94 FKBP1A (0.60) FKBP1AMTORFKBP4FKBP5
SCHEMBL5365881 0.94 FKBP1A (0.59) FKBP1AMTORFKBP4FKBP5
SCHEMBL5373037 0.93 FKBP1A (0.53) FKBP1A
SCHEMBL5369696 0.88 FKBP1A (0.66) FKBP1AMTORFKBP4FKBP5
SCHEMBL5365886 0.83 FKBP1A (0.52) FKBP1A
SCHEMBL5364010 0.83 FKBP1A (0.64) FKBP1AMTORFKBP4FKBP5
SCHEMBL14423330 0.82 FKBP1A (0.51) FKBP1A
SCHEMBL5365865 0.81 FKBP1A (0.50) FKBP1A

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-7253169-B2 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. (US) 2007-08-07 US claimed
US-20020028814-A1 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. 2002-03-07 US claimed
US-7253169-B2 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. (US) 2007-08-07 US disclosed
US-7253169-B2 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. (US) 2007-08-07 US disclosed
US-7253169-B2 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. (US) 2007-08-07 US disclosed
US-6417189-B1 DRUGS WITH PYRAZOLE KETONE DERIVATIVES GPI NIL HOLDINGS, INC. 2002-07-09 US disclosed
US-20020028814-A1 Aza compounds, pharmaceutical compositions and methods of use GLIAMED, INC. 2002-03-07 US disclosed
WO-2001079177-A1 CYCLIC DIAZA COMPOUNDS FOR TREATING NEURODEGENERATIVE DISORDERS GPI NIL HOLDINGS, INC. (US) 2001-10-25 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-20020028814-A1 Aza compounds, pharmaceutical compositions and methods of use GRIN3A, CHRNA5, GRIN3B FKBP1A 1238/4885MTOR 1723/4885FKBP4 1424/4885

“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.