SCHEMBL2894889

SCHEMBL2894889

COC(=O)C(Cc1ccc(O)cc1F)NC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.50
CTSK P43235 6/20 0.50
KLK5 Q9Y337 1/20 0.47
TACR1 P25103 2/20 0.45
PTPN1 P18031 1/20 0.44
SCN9A Q15858 3/20 0.41
MDM4 O15151 1/20 0.41
MDM2 Q00987 1/20 0.41
MAP1LC3B Q9GZQ8 1/20 0.40
MAP1LC3A Q9H492 1/20 0.40
ACE P12821 1/20 0.40

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
SCHEMBL2898437 1.00 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL30765049 1.00 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL30765047 1.00 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL31703417 0.91 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL864799 0.89 PTPN1 (0.54) CTSSCTSKPTPN1SCN9AACE
SCHEMBL31494602 0.89 CTSS (0.51) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL864800 0.89 PTPN1 (0.54) CTSSCTSKPTPN1SCN9AACE
SCHEMBL30765042 0.89 PTPN1 (0.54) CTSSCTSKPTPN1SCN9AACE
SCHEMBL20235970 0.88 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1
SCHEMBL20235969 0.88 CTSS (0.50) CTSSCTSKKLK5TACR1PTPN1

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-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
US-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-11-11 US disclosed
WO-2009034388-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2009-03-19 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-20100286112-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS GPR119, DPP4, DPP9 CTSS 1847/4885CTSK 1525/4885KLK5 1365/4885

“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.