SCHEMBL1968260

SCHEMBL1968260

COCCNC(=O)C(O)C1(NC(=O)OC(C)(C)C)CCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
CTSL P07711 1/20 0.33
POLB P06746 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
HTT P42858 2/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.31
P2RX7 Q99572 1/20 0.31
CTSS P25774 2/20 0.31
CTSK P43235 2/20 0.31
CAPN1 P07384 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL6888536 0.80 CTSL (0.35) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL1965623 0.77 BTK (0.38) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL29395889 0.76 CA1 (0.34) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL29399267 0.72 GAA (0.35) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL16152258 0.71 BTK (0.31) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL791556 0.71 TDP1 (0.56) EPHX1GAAMEN1KMT2AALDH1A1
SCHEMBL2377885 0.70 GAA (0.43) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL15888207 0.70 CTSL (0.37) MEN1KMT2ACTSLCTSSCTSK
SCHEMBL12070311 0.70 GAA (0.39) EPHX1GAAMEN1KMT2ACTSL
SCHEMBL7403325 0.70 KMT2A (0.51) GAAMEN1KMT2ACTSLPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815809-B2 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2014-08-26 US disclosed
US-8815809-B2 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2014-08-26 US disclosed
EP-2509956-B1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD (GB) 2014-07-23 EP disclosed
EP-2509956-B1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD (GB) 2014-07-23 EP disclosed
US-20120309673-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD (GB) 2012-12-06 US disclosed
US-20120309673-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LTD (GB) 2012-12-06 US disclosed
EP-2509956-A1 CYSTEINE PROTEASE INHIBITORS Medivir UK Ltd (GB) 2012-10-17 EP disclosed
WO-2011070539-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LIMITED (GB) 2011-06-16 WO disclosed
WO-2011070539-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR UK LIMITED (GB) 2011-06-16 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 (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-20120309673-A1 CYSTEINE PROTEASE INHIBITORS CTSB, CTSS, CTRB1 EPHX1 328/4885GAA 573/4885MEN1 3820/4885

“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.