SCHEMBL7095893

SCHEMBL7095893

Cn1c(=O)n(Cc2ccc(I)cc2)c(=O)c2cc(C(=O)O)ccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.61
SLC22A8 Q8TCC7 1/20 0.61
HDAC1 Q13547 4/20 0.51
PARG Q86W56 3/20 0.49
KDM4E B2RXH2 2/20 0.45
HPD P32754 2/20 0.44
HDAC6 Q9UBN7 3/20 0.43
HDAC8 Q9BY41 2/20 0.43
MAPK8 P45983 1/20 0.42
PPARG P37231 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TBXAS1 P24557 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
NR4A1 P22736 1/20 0.42

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
SCHEMBL6247398 0.93 MMP13 (0.64) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL6253605 0.89 MMP13 (0.62) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL7100616 0.89 MMP13 (0.62) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL6241073 0.89 MMP13 (0.71) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL6256249 0.88 MMP13 (0.61) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL6238935 0.88 MMP13 (0.61) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL7105420 0.87 MMP13 (0.58) MMP13SLC22A8HDAC1PARGKDM4E
SCHEMBL6256616 0.86 MMP13 (0.59) MMP13SLC22A8HDAC1PARGHDAC6
SCHEMBL7019308 0.86 MMP13 (0.59) MMP13SLC22A8HDAC1PARGSMN1; SMN2
SCHEMBL7105028 0.86 MMP13 (0.59) MMP13SLC22A8HDAC1PARGHDAC6

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
EP-1368324-A1 QUINAZOLINES AS MMP-13 INHIBITORS Warner-Lambert Company LLC (US) 2003-12-10 EP disclosed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US disclosed
WO-2002064572-A1 QUINAZOLINES AS MMP-13 INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 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-20020193377-A1 Quinazolines as MMP-13 inhibitors MMP13, MMP9, MMP3 MMP13 1/4885SLC22A8 315/4885HDAC1 550/4885

“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.