SCHEMBL862897

SCHEMBL862897

CCc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)NS(=O)(=O)c1cccc(NS(C)(=O)=O)c1)n2Cc1ccc(F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.37
CYP2C8 P10632 1/20 0.36
AGTR1 P30556 3/20 0.34
AGTR2 P50052 3/20 0.34
BRD4 O60885 3/20 0.34
SERPINE1 P05121 1/20 0.33
PTGDR2 Q9Y5Y4 3/20 0.33
EP300 Q09472 1/20 0.33
CYP3A4 P08684 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL862184 0.93 PPARG (0.39) PPARGCYP2C8AGTR1AGTR2BRD4
SCHEMBL10254940 0.92 CYP2C8 (0.38) PPARGCYP2C8BRD4PTGDR2EP300
SCHEMBL862564 0.91 CYP2C8 (0.36) PPARGCYP2C8AGTR1AGTR2BRD4
SCHEMBL862901 0.91 CYP2C8 (0.39) PPARGCYP2C8BRD4PTGDR2LOXL2
SCHEMBL862346 0.90 PPARG (0.40) PPARGCYP2C8BRD4SERPINE1
SCHEMBL862753 0.90 PPARG (0.38) PPARGCYP2C8BRD4SERPINE1PTGDR2
SCHEMBL862899 0.90 PPARG (0.42) PPARGCYP2C8BRD4CYP3A4
SCHEMBL862323 0.90 PPARG (0.42) PPARGCYP2C8KMT2A
SCHEMBL862601 0.90 EPHX2 (0.40) PPARGCYP2C8BRD4SERPINE1PTGDR2
SCHEMBL10255439 0.89 CYP2C8 (0.35) PPARGCYP2C8BRD4PTGDR2EP300

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 2 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-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 PPARG 4093/4885CYP2C8 847/4885AGTR1 1013/4885

“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.