SCHEMBL7061584

SCHEMBL7061584

Cn1c2c(c(=O)n(Cc3cc(F)c(O)c(F)c3)c1=O)[S+]([O-])C(C(=O)O)C(=O)N2

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL7061528 0.89 ALDH1A1 (0.36) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL7059744 0.85 GAA (0.43) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL6680685 0.77 MEN1 (0.33) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL7058690 0.76 GAA (0.34) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL7130471 0.76 ALDH1A1 (0.37) MEN1CYP3A4CYP2C9KMT2AALDH1A1
SCHEMBL7127235 0.76 ADORA2A (0.33) MEN1CYP3A4CYP2C9KMT2AL3MBTL1
SCHEMBL7120575 0.73 ALDH1A1 (0.47) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL7116631 0.69 KMT2A (0.47) MEN1CYP3A4CYP2C9KMT2AALDH1A1
SCHEMBL6678802 0.69 CMA1 (0.31)
SCHEMBL7057681 0.68 CMA1 (0.30)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040224951-A1 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-11-11 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-20040224951-A1 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP25 MEN1 3549/4885CYP3A4 1686/4885CYP2C9 841/4885

“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.