SCHEMBL832124

SCHEMBL832124

Cc1ccc(Cn2c(C(=O)NS(=O)(=O)C3CC3)c(-c3ccc[nH]c3=O)c3cc(C(F)(F)F)ccc32)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 8/20 0.39
SCN5A Q14524 6/20 0.39
CYP2C8 P10632 1/20 0.39
PTGDR2 Q9Y5Y4 4/20 0.37
SCN2B O60939 4/20 0.37
SCN1B Q07699 4/20 0.37
SCN1A P35498 3/20 0.37
CCR2 P41597 2/20 0.36
PPARG P37231 2/20 0.35
DDR1 Q08345 1/20 0.35
MGAT2 Q10469 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL831412 0.93 CYP2C8 (0.41) SCN9ASCN5ACYP2C8SCN2BSCN1B
SCHEMBL831952 0.90 PPARG (0.42) SCN9ASCN5ACYP2C8PTGDR2SCN2B
SCHEMBL832018 0.90 SCN9A (0.39) SCN9ASCN5ACYP2C8PTGDR2SCN2B
SCHEMBL831969 0.90 CYP2C8 (0.41) CYP2C8PTGDR2CCR2PPARGDDR1
SCHEMBL831050 0.88 SCN9A (0.41) SCN9ASCN5ACYP2C8SCN2BSCN1B
SCHEMBL831488 0.87 SCN9A (0.40) SCN9ASCN5ACYP2C8PTGDR2SCN2B
SCHEMBL10256456 0.86 CYP2C8 (0.42) SCN9ASCN5ACYP2C8PTGDR2SCN2B
SCHEMBL832019 0.85 KMT2A (0.39) SCN9ASCN5ACYP2C8PPARGEPHX2
SCHEMBL831761 0.85 CYP2C8 (0.41) SCN9ASCN5ACYP2C8PTGDR2SCN2B
SCHEMBL10256969 0.85 CYP2C8 (0.41) SCN9ASCN5ACYP2C8PTGDR2SCN2B

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 SCN9A 3807/4885SCN5A 1398/4885CYP2C8 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.