SCHEMBL14701635

SCHEMBL14701635

COC(=O)[C@@H]1C[C@H](NC(=O)OCc2ccccc2)CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.46
CTSL P07711 1/20 0.46
MMP2 P08253 2/20 0.46
KLK5 Q9Y337 1/20 0.44
SYK P43405 1/20 0.42
CPB1 P15086 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 2/20 0.42
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL12442625 0.87 MMP2 (0.40) ELANECTSLMMP2CPB1ALDH1A1
SCHEMBL12442360 0.85 MMP2 (0.64) ELANEMMP2
SCHEMBL489584 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL29580842 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL25551181 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL24538203 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL25184486 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL9006101 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL19942971 0.85 MMP2 (0.49) CTSLMMP2CPB1ALDH1A1CYP3A4
SCHEMBL12442630 0.84 CPB1 (0.48) CTSLMMP2CPB1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284350-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2016-03-15 US disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 US disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 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-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 ELANE 1258/4885CTSL 2410/4885MMP2 2188/4885

“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.