SCHEMBL16792138

SCHEMBL16792138

CC(=O)c1sc(SC(C)C)c(C#N)c1-c1ccc(Cl)cc1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 0.82
FNTB P49356 19/20 0.82
KMT2A Q03164 1/20 0.82
GRIA4 P48058 1/20 0.61

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
SCHEMBL16792274 0.90 FNTA (1.00) FNTAFNTBKMT2AGRIA4
SCHEMBL18151964 0.89 FNTA (0.80) FNTAFNTBKMT2AGRIA4
SCHEMBL16792214 0.87 FNTA (0.77) FNTAFNTBKMT2AGRIA4
SCHEMBL5756967 0.86 GRIA4 (0.62) FNTAFNTBKMT2AGRIA4
SCHEMBL16798046 0.84 FNTA (0.82) FNTAFNTBKMT2A
SCHEMBL16792007 0.84 FNTA (0.72) FNTAFNTBKMT2AGRIA4
SCHEMBL16792044 0.83 FNTA (0.64) FNTAFNTBKMT2A
SCHEMBL16798062 0.82 FNTA (0.69) FNTAFNTBKMT2AGRIA4
SCHEMBL16792140 0.81 GRIA4 (0.64) FNTAFNTBKMT2AGRIA4
SCHEMBL18151963 0.79 FNTA (0.79) FNTAFNTBKMT2AGRIA4

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-20160375041-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT AUTOIMMUNE DISORDERS TABACZYNSKI DAVID A (US) 2016-12-29 US disclosed
US-20160303146-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT NEUROINFLAMMATORY DISORDERS TABACZYNSKI DAVID A (US) 2016-10-20 US disclosed
WO-2015089349-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT NEUROINFLAMMATORY DISORDERS TABACZYNSKI DAVID A (US) 2015-06-18 WO disclosed
WO-2015084721-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT AUTOIMMUNE DISORDERS TABACZYNSKI DAVID A (US) 2015-06-11 WO 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 (2 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-20160375041-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT AUTOIMMUNE DISORDERS GGPS1, FDPS, COASY FNTA 4/4885FNTB 15/4885KMT2A 4161/4885
US-20160303146-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT NEUROINFLAMMATORY DISORDERS GGPS1, FDPS, COASY FNTA 4/4885FNTB 10/4885KMT2A 4620/4885

“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.