SCHEMBL832336

SCHEMBL832336

CCc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)NS(=O)(=O)C(C)C)n2Cc1ccc2ccccc2c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.38
PPARG P37231 7/20 0.35
KMT2A Q03164 7/20 0.35
MEN1 O00255 2/20 0.34
SERPINE1 P05121 2/20 0.33
RCE1 Q9Y256 1/20 0.33
PTGER3 P43115 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
SCHEMBL831033 0.89 CYP2C8 (0.41) CYP2C8PPARGKMT2AMEN1
SCHEMBL831573 0.88 CYP2C8 (0.38) CYP2C8PTGDR2PPARGKMT2AMEN1
SCHEMBL830785 0.88 CYP2C8 (0.42) CYP2C8PTGDR2KMT2AMEN1PTGER3
SCHEMBL831476 0.85 CYP2C8 (0.39) CYP2C8PTGDR2PPARGKMT2AMEN1
SCHEMBL832181 0.82 CYP2C8 (0.38) CYP2C8PPARGKMT2AMEN1
SCHEMBL832522 0.82 PPARG (0.38) CYP2C8PPARGKMT2A
SCHEMBL830923 0.81 CYP2C8 (0.37) CYP2C8PPARGKMT2AMEN1
SCHEMBL13905346 0.81 CYP2C8 (0.36) CYP2C8
SCHEMBL831710 0.78 CYP2C8 (0.43) CYP2C8PTGDR2KMT2AMEN1
SCHEMBL831530 0.78 CYP2C8 (0.43) CYP2C8PTGDR2KMT2AMEN1PTGER3

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 847/4885PTGDR2 1609/4885PPARG 4093/4885

“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.