SCHEMBL2632237

SCHEMBL2632237

C[C@H]1CN(C(=O)OCc2ccccc2)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]21

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.49
F2 P00734 1/20 0.48
CTSG P08311 1/20 0.48
PDK1 Q15118 1/20 0.48
PDK2 Q15119 1/20 0.48
PDK3 Q15120 1/20 0.48
PDK4 Q16654 1/20 0.48

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
SCHEMBL10170415 0.92 ELANE (0.50) ELANEF2CTSG
SCHEMBL13944496 0.90 ELANE (0.48) ELANEF2CTSG
SCHEMBL13017618 0.90 ELANE (0.48) ELANEF2CTSG
SCHEMBL5941361 0.90 ELANE (0.48) ELANEF2CTSG
SCHEMBL8512106 0.90 ELANE (0.48) ELANEF2CTSG
SCHEMBL9611287 0.90 ELANE (0.48) ELANEF2CTSG
SCHEMBL29662123 0.89 ELANE (0.48) ELANEF2CTSGPDK1PDK2
SCHEMBL1933817 0.89 ELANE (0.48) ELANEF2CTSG
SCHEMBL2622087 0.89 ELANE (0.48) ELANEF2CTSG
SCHEMBL2622141 0.89 ELANE (0.48) ELANEF2CTSG

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-20120094917-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP (US) 2012-04-19 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-20120094917-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 ELANE 692/4885F2 4723/4885CTSG 189/4885

“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.