SCHEMBL831182

SCHEMBL831182

CCc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)NS(=O)(=O)CC)n2Cc1cccc(C)c1F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.42
KMT2A Q03164 6/20 0.36
MEN1 O00255 3/20 0.35
PPARG P37231 5/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
BRD4 O60885 1/20 0.32
EDNRB P24530 1/20 0.32
BRAF P15056 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL832020 0.94 CYP2C8 (0.42) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL831702 0.92 CYP2C8 (0.42) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL832193 0.90 CYP2C8 (0.39) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL831530 0.90 CYP2C8 (0.43) CYP2C8KMT2AMEN1PTGDR2EDNRB
SCHEMBL832381 0.89 CYP2C8 (0.41) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL12665130 0.88 CYP2C8 (0.53) CYP2C8KMT2AMEN1PTGDR2EDNRB
SCHEMBL831814 0.87 CYP2C8 (0.40) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL861889 0.86 CYP2C8 (0.43) CYP2C8KMT2AMEN1PPARGEDNRB
SCHEMBL831181 0.85 CYP2C8 (0.43) CYP2C8KMT2AMEN1PPARGPTGDR2
SCHEMBL10256115 0.83 CYP2C8 (0.45) CYP2C8KMT2AMEN1PPARGPTGDR2

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 CYP2C8 847/4885KMT2A 321/4885MEN1 2084/4885

“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.