SCHEMBL4817606

SCHEMBL4817606

Cn1nc(C(C)(C)C)cc1C(=O)N1CCC(C)(C)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
GRN P28799 1/20 0.54
SORT1 Q99523 1/20 0.54
LMNA P02545 3/20 0.45
ALDH1A1 P00352 1/20 0.45
NAMPT P43490 1/20 0.44
SPR P35270 1/20 0.41
MAPT P10636 1/20 0.40
CTSL P07711 2/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
NAA50 Q9GZZ1 3/20 0.39
EPHX2 P34913 1/20 0.38
GALR3 O60755 2/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
CTSB P07858 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
SCHEMBL4817595 1.00 KDM4E (0.54) KDM4EGRNSORT1LMNAALDH1A1
SCHEMBL4817598 0.77 GRN (0.52) KDM4EGRNSORT1LMNAALDH1A1
SCHEMBL6413925 0.75 GRN (0.50) KDM4EGRNSORT1LMNAALDH1A1
SCHEMBL2857998 0.74 F11 (0.52) KDM4EGRNSORT1ALDH1A1SPR
SCHEMBL6418537 0.73 KDM4E (0.44) KDM4EGRNSORT1LMNAALDH1A1
SCHEMBL4423533 0.73 NAA50 (0.52) KDM4EGRNSORT1LMNANAMPT
SCHEMBL4284018 0.73 KDM4E (0.50) KDM4EGRNSORT1LMNAALDH1A1
SCHEMBL17176296 0.71 KDM4E (0.55) KDM4ELMNAALDH1A1NAMPTSPR
SCHEMBL8260077 0.71 GRN (0.73) KDM4EGRNSORT1LMNAMAPT
SCHEMBL1572486 0.71 GRN (1.00) KDM4EGRNSORT1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US claimed
US-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION 2005-11-03 US claimed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP claimed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO claimed
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US disclosed
US-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION 2005-11-03 US disclosed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP disclosed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 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-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss CTSK, CTSB, CTSD KDM4E 209/4885GRN 3025/4885SORT1 4194/4885

“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.