SCHEMBL6680685

SCHEMBL6680685

Cn1c2c(c(=O)n(Cc3cc(F)c(O)c(F)c3)c1=O)SC(C(=O)O)C(=O)N2

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CMA1 P23946 1/20 0.31
HPD P32754 2/20 0.31
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6678209 0.89 ALDH1A1 (0.38) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL6683575 0.84 GAA (0.46) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL6678802 0.79 CMA1 (0.31) CMA1PKMRAB9ASMN1; SMN2
SCHEMBL7058690 0.78 GAA (0.34) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL7061584 0.77 MEN1 (0.32) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL6683259 0.75 ALDH1A1 (0.35) KMT2AL3MBTL1ALDH1A1PKMNPSR1
SCHEMBL7057681 0.70 CMA1 (0.30) CMA1
SCHEMBL6678368 0.68 MEN1 (0.41) MEN1CYP3A4CYP2C9KMT2AGAA
SCHEMBL6664692 0.68 GAA (0.30) GAALMNAHTT
SCHEMBL6680501 0.68 PTGS1 (0.34) L3MBTL1ALDH1A1PKMRAB9ASMN1; SMN2

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-20040224951-A1 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-11-11 US disclosed
WO-2004014921-A1 5,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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 (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.