SCHEMBL3387910

SCHEMBL3387910

C[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.59
HPGD P15428 3/20 0.59
GLA P06280 1/20 0.59
GAA P10253 1/20 0.59
MAPT P10636 1/20 0.59
EPHX2 P34913 1/20 0.48
SRC P12931 1/20 0.45
MIF P14174 1/20 0.43
CTSS P25774 2/20 0.43
CTSK P43235 2/20 0.43
ELANE P08246 4/20 0.43
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
KDM1A O60341 1/20 0.39
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
MMP13 P45452 1/20 0.38

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
SCHEMBL8668852 1.00 KDM4E (0.59) KDM4EHPGDGLAGAAMAPT
SCHEMBL30184764 0.94 KDM4E (0.64) KDM4EHPGDGLAGAAMAPT
SCHEMBL23493263 0.94 KDM4E (0.64) KDM4EHPGDGLAGAAMAPT
SCHEMBL23493265 0.94 KDM4E (0.64) KDM4EHPGDGLAGAAMAPT
SCHEMBL6557860 0.87 MAPT (0.58) KDM4EHPGDGLAGAAMAPT
SCHEMBL7266767 0.87 KDM4E (0.57) KDM4EHPGDGLAGAAMAPT
SCHEMBL8837503 0.87 KDM4E (0.57) KDM4EHPGDGLAGAAMAPT
SCHEMBL2390983 0.83 MAPT (0.55) KDM4EHPGDGLAGAAMAPT
SCHEMBL29401387 0.83 MAPT (0.55) KDM4EHPGDGLAGAAMAPT
SCHEMBL2390989 0.83 MAPT (0.55) KDM4EHPGDGLAGAAMAPT

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-8524657-B2 Peptidic compounds UNIVERSITY OF WOLLONGONG (AU) 2013-09-03 US disclosed
EP-1836159-B1 Antibiotic binaphthyl derivatives UNIV WOLLONGONG (AU) 2013-04-10 EP disclosed
US-20110312875-A1 PEPTIDIC COMPOUNDS UNIVERSITY OF WOLLONGONG (AU) 2011-12-22 US disclosed
EP-2199300-A2 Peptidic compounds The University Of Wollongong (AU) 2010-06-23 EP 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-20110312875-A1 PEPTIDIC COMPOUNDS VIP, NGLY1, FURIN KDM4E 2877/4885HPGD 2568/4885GLA 2852/4885

“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.