SCHEMBL6318663

SCHEMBL6318663

CCCCCS(=O)(=O)NC(=O)c1ccc2[nH]c(C)c(Cc3ccc(COC4CCCCC4)cc3Cl)c2c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.40
PPARG P37231 1/20 0.40
MCL1 Q07820 6/20 0.38
PTPN5 P54829 1/20 0.36
RAB9A P51151 1/20 0.35
NR1H4 Q96RI1 3/20 0.35
PTPN1 P18031 1/20 0.34
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
POLB P06746 1/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL6134778 0.85 MCL1 (0.41) PPARGMCL1PTPN5PTPN1POLB
SCHEMBL6322473 0.85 SCN9A (0.41) SCN9APPARGMCL1PTPN5RAB9A
SCHEMBL5881578 0.84 PPARG (0.55) PPARGMCL1CNR1
SCHEMBL6319665 0.83 KDM4E (0.46) SCN9APTPN5RAB9APOLB
SCHEMBL5881907 0.83 PPARG (0.54) PPARGMCL1PTPN1CNR1
SCHEMBL5881789 0.83 PPARG (0.54) PPARGMCL1PTPN1CNR1
SCHEMBL6319251 0.83 PTPN5 (0.52) SCN9APPARGPTPN5RAB9ATLR8
SCHEMBL5882099 0.82 PPARG (0.46) PPARGMCL1PTPN5PTPN1CNR1
SCHEMBL6320738 0.82 PPARG (0.46) PPARGPTPN5PTPN1CNR1
SCHEMBL6134732 0.82 MAPT (0.44) PPARGMCL1PTPN5NR1H4POLB

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-20050171185-A1 Indole derivatives FUJISAWA PHARMACEUTICAL CO., LTD., A JAPANESE CORPORATION 2005-08-04 US claimed
EP-1070705-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-24 EP claimed
US-20050171185-A1 Indole derivatives FUJISAWA PHARMACEUTICAL CO., LTD., A JAPANESE CORPORATION 2005-08-04 US disclosed
EP-1070705-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-24 EP 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-20050171185-A1 Indole derivatives PDE5A, IGFBP5, HTR5A SCN9A 1847/4885PPARG 2279/4885MCL1 3761/4885

“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.