SCHEMBL4041237

SCHEMBL4041237

CC(C)CC(NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC2C1C(=O)CN2C(=O)c1cccnc1

nearest known ligand 0.82

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 11/20 0.82
CTSS P25774 1/20 0.62
PREP P48147 2/20 0.43
FAP Q12884 1/20 0.43
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.39
THRB P10828 1/20 0.39
CCR1 P32246 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.37

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
SCHEMBL4215663 1.00 CTSK (0.82) CTSKCTSSPREPFAPRAB9A
SCHEMBL5941468 1.00 CTSK (0.82) CTSKCTSSPREPFAPRAB9A
SCHEMBL4215661 1.00 CTSK (0.82) CTSKCTSSPREPFAPRAB9A
SCHEMBL4043042 0.91 CTSK (0.68) CTSKCTSSPREPFAPALDH1A1
SCHEMBL4219546 0.90 CTSK (0.84) CTSKCTSSPREPFAPALDH1A1
SCHEMBL4041855 0.90 CTSK (0.84) CTSKCTSSPREPFAPALDH1A1
SCHEMBL5942295 0.90 CTSK (0.84) CTSKCTSSPREPFAPALDH1A1
SCHEMBL4219542 0.90 CTSK (0.84) CTSKCTSSPREPFAPALDH1A1
SCHEMBL4039102 0.90 CTSK (1.00) CTSKCTSSPREPFAPCCR1
SCHEMBL4210236 0.90 CTSK (1.00) CTSKCTSSPREPFAPCCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP claimed
US-20060100431-A1 Biologically active compounds AMURA THERAPEUTICS LIMITED (GB) 2006-05-11 US claimed
EP-1546150-A1 BIOLOGICALLY ACTIVE COMPOUNDS Amura Therapeutics Limited (GB) 2005-06-29 EP claimed
WO-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 WO claimed
EP-1689720-B1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA SA (FR) 2009-04-15 EP disclosed
EP-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP disclosed
US-20060100431-A1 Biologically active compounds AMURA THERAPEUTICS LIMITED (GB) 2006-05-11 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-20060100431-A1 Biologically active compounds SOST, CTSK, CTSS CTSK 2/4885CTSS 3/4885PREP 1823/4885

“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.