SCHEMBL832169

SCHEMBL832169

Cc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)NS(=O)(=O)N(C)C)n2Cc1cc2ccccc2nc1Cl

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.61
KMT2A Q03164 7/20 0.37
PTGDR2 Q9Y5Y4 6/20 0.37
RCE1 Q9Y256 1/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
AURKA O14965 1/20 0.33
TPX2 Q9ULW0 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
HPGD P15428 1/20 0.33
PTGER4 P35408 1/20 0.33
PTGS1 P23219 1/20 0.33
SCN9A Q15858 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL13905161 0.91 CYP2C8 (0.50) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL832172 0.90 CYP2C8 (0.76) CYP2C8KMT2ARCE1KDM4EALDH1A1
SCHEMBL831122 0.89 CYP2C8 (0.59) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL13906259 0.86 CYP2C8 (0.79) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL12665812 0.86 CYP2C8 (0.69) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL832115 0.85 CYP2C8 (0.62) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL13395318 0.84 CYP2C8 (0.51) CYP2C8KMT2ARCE1FAAH
SCHEMBL832720 0.84 CYP2C8 (0.60) CYP2C8KMT2APTGDR2RCE1KDM4E
SCHEMBL862450 0.83 CYP2C8 (0.60) CYP2C8KMT2ARCE1KDM4EALDH1A1
SCHEMBL13395355 0.83 CYP2C8 (0.57) CYP2C8KMT2ARCE1MEN1SCN9A

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-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 US 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-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS IDO2, IDO1, IRF3 CYP2C8 847/4885KMT2A 321/4885PTGDR2 1609/4885

“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.