SCHEMBL2622141

SCHEMBL2622141

CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1C(C(=O)O)CN2C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.48
AGTR2 P50052 1/20 0.48
F2 P00734 2/20 0.46
CTSG P08311 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
SCHEMBL1933817 1.00 ELANE (0.48) ELANEAGTR2F2CTSG
SCHEMBL2622087 1.00 ELANE (0.48) ELANEAGTR2F2CTSG
SCHEMBL1934454 0.92 CYP2C19 (0.47) ELANEAGTR2F2CTSG
SCHEMBL2622140 0.91 ELANE (0.46) ELANEF2CTSG
SCHEMBL2114028 0.91 ELANE (0.46) ELANEF2CTSG
SCHEMBL2622107 0.91 ELANE (0.46) ELANEF2CTSG
SCHEMBL2622091 0.91 ELANE (0.46) ELANEF2CTSG
SCHEMBL1933998 0.90 ELANE (0.45) ELANEAGTR2F2CTSG
SCHEMBL12556498 0.90 ELANE (0.45) ELANEAGTR2F2CTSG
SCHEMBL1934030 0.90 ELANE (0.45) ELANEAGTR2F2CTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481495-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS CORPORATION (US) 2013-07-09 US disclosed
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 692/4885AGTR2 697/4885F2 4723/4885

“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.