SCHEMBL13601195

SCHEMBL13601195

CC(C)(C)OC(=O)N1C(=O)CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 10/20 0.52
KLK7 P49862 2/20 0.50
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
CTSL P07711 1/20 0.43
PARP1 P09874 1/20 0.43
F2 P00734 1/20 0.43
HPGD P15428 1/20 0.43
KLK5 Q9Y337 1/20 0.42

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
SCHEMBL12890921 0.93 KLK7 (0.49) FKBP1AKLK7CTSLPARP1F2
SCHEMBL842288 0.93 KLK7 (0.49) FKBP1AKLK7CTSLPARP1F2
SCHEMBL1300740 0.93 KLK7 (0.49) FKBP1AKLK7CTSLPARP1F2
SCHEMBL31390581 0.87 FKBP1A (0.48) FKBP1AKLK7CTSLPARP1F2
SCHEMBL9951077 0.84 KLK7 (0.47) FKBP1AKLK7CYP2C19PARP1F2
SCHEMBL7420306 0.84 KLK7 (0.47) FKBP1AKLK7CYP2C19PARP1F2
SCHEMBL2924800 0.83 FKBP1A (0.45) FKBP1AKLK7CTSLF2HPGD
SCHEMBL13601193 0.82 FKBP1A (0.47) FKBP1AKLK7CTSLF2HPGD
SCHEMBL16584576 0.82 FKBP1A (0.41) FKBP1AKLK7HPGD
SCHEMBL15281912 0.82 FKBP1A (0.41) FKBP1AKLK7HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306062-A1 2,5-Disubstituted Piperidines NOVARTIS AG (CH) 2009-12-10 US 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-20090306062-A1 2,5-Disubstituted Piperidines REN, AGTR1, AGTR2 FKBP1A 2153/4885KLK7 2495/4885CYP3A4 542/4885

“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.