SCHEMBL832104

SCHEMBL832104

Cc1cc2c(-c3ccc[nH]c3=O)c(C(=O)NS(=O)(=O)C(C)C)n(Cc3cc(F)ccc3F)c2cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.44
GNRHR P30968 1/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 2/20 0.33
PTGDR2 Q9Y5Y4 5/20 0.32
PPARG P37231 5/20 0.31
CYP2C9 P11712 1/20 0.31
PTGDR Q13258 1/20 0.31
WDR5 P61964 3/20 0.31
NTRK1 P04629 1/20 0.30

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
SCHEMBL831486 0.93 CYP2C8 (0.47) CYP2C8GNRHRKMT2AMEN1PPARG
SCHEMBL832103 0.89 CYP2C8 (0.43) CYP2C8GNRHRKMT2AMEN1PPARG
SCHEMBL831233 0.87 CYP2C8 (0.42) CYP2C8KMT2AMEN1PTGDR2CYP2C9
SCHEMBL12673670 0.86 CYP2C8 (0.57) CYP2C8GNRHRKMT2AMEN1PTGDR2
SCHEMBL831476 0.84 CYP2C8 (0.39) CYP2C8KMT2AMEN1PTGDR2PPARG
SCHEMBL831531 0.84 CYP2C8 (0.48) CYP2C8GNRHRKMT2AMEN1PPARG
SCHEMBL830778 0.83 CYP2C8 (0.54) CYP2C8KMT2AMEN1PTGDR2PPARG
SCHEMBL831710 0.83 CYP2C8 (0.43) CYP2C8KMT2AMEN1PTGDR2CYP2C9
SCHEMBL831116 0.83 CYP2C8 (0.49) CYP2C8KMT2AMEN1PPARG
SCHEMBL831258 0.83 CYP2C8 (0.53) CYP2C8KMT2AMEN1PTGDR2

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 847/4885GNRHR 3611/4885KMT2A 321/4885

“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.