SCHEMBL2632142

SCHEMBL2632142

COC(=O)[C@H]1CN[C@@H]2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)[C@H]12

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.36
CTSL P07711 2/20 0.35
KLK5 Q9Y337 1/20 0.33
CTSB P07858 1/20 0.32
CTSK P43235 1/20 0.32

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
SCHEMBL2632095 0.85 AAK1 (0.36) ELANECTSLKLK5CTSK
SCHEMBL2113574 0.85 AAK1 (0.36) ELANECTSLKLK5CTSK
SCHEMBL2117853 0.77 ELANE (0.34) ELANECTSLKLK5
SCHEMBL2622165 0.77 ELANE (0.34) ELANECTSLKLK5
SCHEMBL30556768 0.75 CTSL (0.37) ELANECTSLKLK5CTSBCTSK
SCHEMBL8046113 0.75 KLK5 (0.51) ELANEKLK5
SCHEMBL14202917 0.75 KLK5 (0.51) ELANEKLK5
SCHEMBL26120681 0.74 CTSL (0.39) ELANECTSLKLK5CTSBCTSK
SCHEMBL26120677 0.74 CTSL (0.39) ELANECTSLKLK5CTSBCTSK
SCHEMBL2116965 0.74 ELANE (0.37) ELANEKLK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130274278-A1 IAP INHIBITORS TETRALOGIC PHARM CORP (US) 2013-10-17 US disclosed
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
WO-2010138496-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2010-12-02 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 (2 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-20130274278-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 ELANE 692/4885CTSL 134/4885KLK5 2327/4885
US-20120094917-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 ELANE 692/4885CTSL 134/4885KLK5 2327/4885

“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.