SCHEMBL6748453

SCHEMBL6748453

CC(c1ccc(C(=O)O)cc1)C1Cc2cc(C(=O)NCc3cccnc3)ncc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.45
LMNA P02545 6/20 0.41
ALDH1A1 P00352 6/20 0.41
HTT P42858 4/20 0.41
PTGER4 P35408 1/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 3/20 0.41
TSHR P16473 2/20 0.41
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 1/20 0.39
USP2 O75604 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL6748445 0.71 MMP13 (0.46) MMP13LMNAALDH1A1HTTNPSR1
SCHEMBL14534658 0.66 LMNA (0.78) MMP13LMNAALDH1A1HTTPOLB
SCHEMBL1567098 0.65 NAMPT (0.67) LMNAALDH1A1HTTPOLBGAA
SCHEMBL18416069 0.65 MMP13 (1.00) MMP13LMNAALDH1A1HTTPOLB
SCHEMBL23287937 0.65 RAMP1 (0.52) LMNAALDH1A1POLBGAAMAPT
SCHEMBL5209577 0.64 MMP13 (0.73) MMP13LMNAALDH1A1HTTPOLB
SCHEMBL6273019 0.64 MMP13 (0.84) MMP13LMNAGAA
SCHEMBL29899614 0.64 ALDH1A1 (0.55) LMNAALDH1A1HTTNPSR1TSHR
SCHEMBL23143509 0.64 ALDH1A1 (0.55) LMNAALDH1A1HTTNPSR1TSHR
SCHEMBL15162623 0.63 PKM (0.54) LMNAALDH1A1HTTPOLBHPGD

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 MMP13 1/4885LMNA 2399/4885ALDH1A1 675/4885

“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.