SCHEMBL5465729

SCHEMBL5465729

CS(=O)(=O)N(C(=O)Cn1c(-c2ccc(O)c(F)c2)c(C2CCCCC2)c2ccc(C(=O)O)cc21)S(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.39
MMP12 P39900 1/20 0.39
SCN9A Q15858 7/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NR1I2 O75469 3/20 0.33
EGLN1 Q9GZT9 1/20 0.32
STAT3 P40763 2/20 0.31

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
SCHEMBL5435271 0.90 PRKCA (0.42) PRKCAMMP12SCN9AKDM4ELMNA
SCHEMBL5783672 0.87 PRKCA (0.46) PRKCAMMP12SCN9ANR1I2
SCHEMBL5476544 0.86 PRKCA (0.42) PRKCAMMP12SCN9ANR1I2EGLN1
SCHEMBL5470483 0.85 SCN9A (0.44) PRKCAMMP12SCN9AHSD17B10NR1I2
SCHEMBL5817418 0.83 SCN9A (0.53) PRKCAMMP12SCN9ANR1I2
SCHEMBL5434925 0.83 PRKCA (0.43) PRKCAMMP12SCN9A
SCHEMBL5440051 0.79 PRKCA (0.44) PRKCAMMP12SCN9ANR1I2
SCHEMBL5443976 0.78 PRKCA (0.45) PRKCAMMP12SCN9AEGLN1
SCHEMBL5819417 0.78 PRKCA (0.43) PRKCAMMP12SCN9ANR1I2
SCHEMBL5437635 0.77 PRKCA (0.44) PRKCAMMP12SCN9ANR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007516158-A 2007-06-21 JP claimed
EP-1613634-A1 INDOLE ACETAMIDES AS INHIBITORS OF THE HEPATITIS C VIRUS NS5B POLYMERASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-01-11 EP claimed
WO-2004087714-A1 INDOLE ACETAMIDES AS INHIBITORS OF THE HEPATITIS C VIRUS NS5B POLYMERASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2004-10-14 WO claimed
EP-1613634-A1 INDOLE ACETAMIDES AS INHIBITORS OF THE HEPATITIS C VIRUS NS5B POLYMERASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-01-11 EP disclosed
WO-2004087714-A1 INDOLE ACETAMIDES AS INHIBITORS OF THE HEPATITIS C VIRUS NS5B POLYMERASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2004-10-14 WO disclosed