SCHEMBL6750632

SCHEMBL6750632

CN1C(=O)C(Cc2ccc(C(=O)O)cc2)Cc2cc(C(=O)OCc3cccnc3)ncc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
FOLH1 Q04609 3/20 0.36
HDAC8 Q9BY41 1/20 0.36
PDE4D Q08499 1/20 0.36
CYP19A1 P11511 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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 0.85 MMP13 (0.46) L3MBTL1KMT2ALMNATSHRALDH1A1
SCHEMBL6750636 0.71 PTGER4 (0.38) HTR7KMT2ALMNATDP1HDAC8
SCHEMBL6750713 0.68 KDM4E (0.46) FOLH1ALDH1A1SMN1; SMN2
SCHEMBL6844749 0.63 KMT2A (0.52) KMT2ALMNATDP1KDM4CCYP19A1
SCHEMBL6747401 0.63 PTK2 (0.38) HTR7KMT2A
Hydrochloric Acid SCHEMBL10932063 0.62 LMNA (0.52) KMT2ALMNATDP1KDM4CALDH1A1
SCHEMBL18906035 0.62 NR4A2 (0.69) KMT2ACYP19A1CYP11B1CYP11B2SMN1; SMN2
SCHEMBL6234751 0.62 KMT2A (0.59) L3MBTL1KMT2ALMNATDP1TSHR
SCHEMBL30335693 0.62 KMT2A (0.82) KMT2ALMNATDP1TSHRCYP19A1
SCHEMBL27597233 0.62 KMT2A (0.82) KMT2ALMNATDP1TSHRCYP19A1

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-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 HTR7 4544/4885L3MBTL1 3621/4885KMT2A 2652/4885

“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.