SCHEMBL6683313

SCHEMBL6683313

CN1CC(C(=O)O)=Cc2c1n(C)c(=O)n(Cc1cc(F)c(O)c(F)c1)c2=O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 2/20 0.31
CMA1 P23946 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 2/20 0.30
P2RX7 Q99572 1/20 0.30
MEN1 O00255 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
SCHEMBL6681187 0.88 PTGS1 (0.35) SMN1; SMN2PKMRAB9AALDH1A1LMNA
SCHEMBL6681995 0.83 SMN1; SMN2 (0.48) SMN1; SMN2PKMRAB9AALDH1A1LMNA
SCHEMBL6683636 0.81 PARP1 (0.34) SMN1; SMN2
SCHEMBL6666868 0.80 P2RX7 (0.31) SMN1; SMN2PKMRAB9ACMA1P2RX7
SCHEMBL6705127 0.71 PTGS1 (0.38) SMN1; SMN2PKMRAB9AALDH1A1TSHR
SCHEMBL6683778 0.69 PARP1 (0.39) SMN1; SMN2ALDH1A1TSHR
SCHEMBL6692406 0.69 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL6679104 0.69 PTGS1 (0.36) ALDH1A1TSHR
SCHEMBL6663839 0.69 ALDH1A1 (0.36) SMN1; SMN2PKMRAB9AALDH1A1TSHR
SCHEMBL7063524 0.68 LIPG (0.31)

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 SMN1; SMN2 682/4885PKM 2081/4885RAB9A 627/4885

“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.