SCHEMBL4415855

SCHEMBL4415855

C[S+]([O-])c1ccc(-c2noc(COC3CCN(C(=O)OC(C)(C)C)CC3)n2)cc1[S+](C)[O-]

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.69
HDAC4 P56524 4/20 0.44
HDAC6 Q9UBN7 2/20 0.41
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
CETP P11597 2/20 0.39
CHEK2 O96017 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
LMNA P02545 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
SCHEMBL4422346 0.93 GPR119 (0.67) GPR119HDAC4HDAC6PTPN2PTPN1
SCHEMBL4415988 0.93 GPR119 (0.67) GPR119HDAC4HDAC6PTPN2PTPN1
SCHEMBL4413016 0.93 GPR119 (0.66) GPR119HDAC4HDAC6
SCHEMBL4419628 0.92 GPR119 (0.65) GPR119HDAC4HDAC6PDE4APDE4B
SCHEMBL4422093 0.89 GPR119 (0.75) GPR119HDAC4HDAC6PTPN2PTPN1
SCHEMBL13598257 0.85 GPR119 (0.62) GPR119HDAC4HDAC6
SCHEMBL4416375 0.85 GPR119 (0.67) GPR119HDAC4HDAC6
SCHEMBL4415575 0.85 GPR119 (0.55) GPR119HDAC4HDAC6LMNA
SCHEMBL14640607 0.84 GPR119 (0.74) GPR119HDAC4HDAC6PTPN2PTPN1
SCHEMBL4420409 0.84 GPR119 (0.61) GPR119HDAC4HDAC6PTPN2PTPN1

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-20090325924-A1 GPCR Agonists PROSIDION LIMITED (GB) 2009-12-31 US disclosed
US-20090325924-A1 GPCR Agonists PROSIDION LIMITED (GB) 2009-12-31 US disclosed
US-20090325924-A1 GPCR Agonists PROSIDION LIMITED (GB) 2009-12-31 US disclosed
WO-2007003960-A1 GPCR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 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-20090325924-A1 GPCR Agonists GPR119, GCGR, GPR27 GPR119 1/4885HDAC4 2550/4885HDAC6 2609/4885

“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.