SCHEMBL6745751

SCHEMBL6745751

CN1C(=O)C(Cc2cc(F)c(O)c(F)c2)Cc2cc(C(=O)O)ccc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HTR7 P34969 9/20 0.35
VRK1 Q99986 1/20 0.35
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
NR4A1 P22736 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL8345369 0.81 MAPT (0.40) MAPTHPGDLMNAHTR7KDM4E
SCHEMBL30489343 0.67 DRD2 (0.46) MAPTL3MBTL1POLBGAA
SCHEMBL28995160 0.67 DRD2 (0.46) MAPTL3MBTL1POLBGAA
SCHEMBL6680077 0.66 NR1H2 (0.40) HPGDHTR7NR1H2NR1H3KDM4E
SCHEMBL31348187 0.65 SMYD3 (0.60) MAPTHPGDLMNANR1H2NR1H3
SCHEMBL1965892 0.65 SMYD3 (0.60) MAPTHPGDLMNANR1H2NR1H3
SCHEMBL6685279 0.64 NR1H2 (0.38) HPGDNR1H2NR1H3KDM4E
SCHEMBL23535782 0.64 LMNA (0.49) MAPTHPGDLMNAL3MBTL1NR1H2
SCHEMBL20894244 0.64 LMNA (0.56) MAPTHPGDLMNASMYD3GAA
SCHEMBL30040376 0.64 LMNA (0.49) MAPTHPGDLMNAL3MBTL1NR1H2

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
US-20040043984-A1 3,4-Dihydroquinolin-2-one, 5,6-fused oxazin-3-one, and 5,6-fused thiazin-3-one derivatives as matrix metalloproteinase inhibitors O'BRIEN PATRICK MICHAEL (US) 2004-03-04 US claimed
WO-2004014389-A1 3,4-DIHYDROQUINOLIN-2-ONE, 5,6-FUSED OXAZIN-3-ONE, AND 5,6-FUSED THIAZIN-3-ONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-20040043984-A1 3,4-Dihydroquinolin-2-one, 5,6-fused oxazin-3-one, and 5,6-fused thiazin-3-one derivatives as matrix metalloproteinase inhibitors O'BRIEN PATRICK MICHAEL (US) 2004-03-04 US disclosed
WO-2004014389-A1 3,4-DIHYDROQUINOLIN-2-ONE, 5,6-FUSED OXAZIN-3-ONE, AND 5,6-FUSED THIAZIN-3-ONE 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-20040043984-A1 3,4-Dihydroquinolin-2-one, 5,6-fused oxazin-3-one, and 5,6-fused thiazin-3-one derivatives as matrix metalloproteinase inhibitors MMP13, MMP9, MMP3 MAPT 1797/4885HPGD 257/4885LMNA 2399/4885

“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.