SCHEMBL862268

SCHEMBL862268

CCNC(=O)Nc1cccc(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2Cc2ccc(F)cc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.40
AGTR2 P50052 6/20 0.40
CYP2C8 P10632 1/20 0.37
RIPK3 Q9Y572 1/20 0.35
PPARG P37231 5/20 0.34
EPHX2 P34913 2/20 0.34
CYSLTR1 Q9Y271 2/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
PDE4A P27815 1/20 0.33
PDE7A Q13946 1/20 0.33
IDH1 O75874 1/20 0.33

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
SCHEMBL10255303 0.92 CYP2C8 (0.39) AGTR1AGTR2CYP2C8RIPK3PPARG
SCHEMBL862042 0.90 CYP2C8 (0.38) AGTR1AGTR2CYP2C8RIPK3PPARG
SCHEMBL10258012 0.90 CYP2C8 (0.38) CYP2C8RIPK3PPARGEPHX2MAPT
SCHEMBL862901 0.90 CYP2C8 (0.39) CYP2C8RIPK3PPARGMAPTMEN1
SCHEMBL10255027 0.88 CYP2C8 (0.40) CYP2C8PPARGMAPTMEN1ALDH1A1
SCHEMBL831326 0.88 CYP2C8 (0.40) CYP2C8PPARGKMT2APDE4APDE7A
SCHEMBL862466 0.86 CYP2C8 (0.36) CYP2C8RIPK3PPARGEPHX2CYSLTR1
SCHEMBL862717 0.85 CYP2C8 (0.42) CYP2C8PPARGMEN1KMT2A
SCHEMBL862590 0.85 CYP2C8 (0.39) CYP2C8PPARGMAPTMEN1ALDH1A1
SCHEMBL862158 0.84 CYP2C8 (0.41) CYP2C8PPARGMEN1KMT2A

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 AGTR1 1013/4885AGTR2 350/4885CYP2C8 847/4885

“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.