SCHEMBL6683643

SCHEMBL6683643

COc1cccc(CNC(=O)C2=Cn3c(c(C)c(=O)n(Cc4ccccc4)c3=O)CS2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
RAB9A P51151 1/20 0.46
PPARG P37231 1/20 0.45
TRPA1 O75762 2/20 0.45
RXFP1 Q9HBX9 3/20 0.45
MMP13 P45452 1/20 0.44
NR3C2 P08235 1/20 0.43
TOP2A P11388 1/20 0.43
TP53 P04637 6/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
CASP3 P42574 1/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL6718409 0.85 THRB (0.43) MAPTRAB9ARXFP1TP53KDM4E
SCHEMBL6718675 0.85 MAPT (0.51) MAPTRAB9APPARGTRPA1RXFP1
SCHEMBL6678339 0.83 MAPT (0.51) MAPTRAB9APPARGTRPA1RXFP1
SCHEMBL6680635 0.79 TRPA1 (0.41) RAB9ATRPA1TP53LMNA
SCHEMBL6683536 0.76 TRPA1 (0.45) MAPTPPARGTRPA1TP53POLB
SCHEMBL5957675 0.75 TRPA1 (0.79) MAPTRAB9ATRPA1NR3C2TP53
SCHEMBL6681435 0.73 THRB (0.43) MAPTRAB9ARXFP1TP53KDM4E
SCHEMBL6664200 0.73 MAPT (0.47) MAPTRAB9ARXFP1MMP13NR3C2
SCHEMBL6665653 0.72 MMP1 (0.43) MAPTRAB9ARXFP1TP53KDM4E
SCHEMBL6685134 0.72 MAPT (0.49) MAPTRAB9ARXFP1MMP13NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 1535/4885RAB9A 672/4885PPARG 2998/4885

“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.