SCHEMBL6684992

SCHEMBL6684992

Cc1c2n(c(=O)n(Cc3ccccc3)c1=O)C=C(C(=O)O)NC2

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 6/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
NOTUM Q6P988 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 2/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PSMD14 O00487 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37
FABP4 P15090 1/20 0.37
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6680959 0.85 ALDH1A1 (0.38) TSHRRAB9AKDM4EHTT
SCHEMBL6684000 0.83 ABCB1 (0.35) TRPA1SMN1; SMN2RAB9AKDM4ELMNA
SCHEMBL6665653 0.80 MMP1 (0.43) RAB9AKDM4EFABP4
SCHEMBL6678339 0.79 MAPT (0.51) TRPA1KMT2AMEN1HPGDRAB9A
SCHEMBL6682079 0.77 NOTUM (0.40) TRPA1NOTUMKMT2AMEN1TSHR
SCHEMBL6680635 0.77 TRPA1 (0.41) TRPA1GSK3AGSK3BNOTUMTSHR
SCHEMBL6679307 0.71 TRPA1 (0.43) TRPA1KMT2AMEN1TSHRHPGD
SCHEMBL7821723 0.66 LMNA (0.50) GSK3AGSK3BTSHRSMN1; SMN2KDM4E
SCHEMBL6259085 0.65 TRPA1 (0.48) TRPA1NOTUMKMT2AMEN1TSHR
SCHEMBL6260122 0.65 TRPA1 (0.48) TRPA1NOTUMKMT2AMEN1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004014354-A1 1,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-02-19 US claimed
US-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-02-19 US disclosed
WO-2004014354-A1 1,6-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-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP11 TRPA1 4681/4885GSK3A 1542/4885GSK3B 1186/4885

“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.