SCHEMBL7106533

SCHEMBL7106533

Cn1c(=O)n(Cc2ccncc2)c(=O)c2cc(C(=O)O)ccc21

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.59
SLC22A8 Q8TCC7 1/20 0.59
PARG Q86W56 7/20 0.55
TBXAS1 P24557 1/20 0.49
HDAC1 Q13547 1/20 0.46
KDM4E B2RXH2 1/20 0.45
HPD P32754 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 1/20 0.44
DPP4 P27487 1/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2B Q13224 2/20 0.43
CNR2 P34972 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
SCHEMBL6241073 0.89 MMP13 (0.71) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL6432931 0.88 MMP13 (0.55) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL7097504 0.87 PARG (0.57) MMP13SLC22A8PARGHDAC1CNR2
SCHEMBL6253605 0.87 MMP13 (0.62) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL7100616 0.87 MMP13 (0.62) MMP13SLC22A8PARGTBXAS1HDAC1
SCHEMBL7095893 0.86 MMP13 (0.61) MMP13SLC22A8PARGTBXAS1HDAC1
SCHEMBL6238935 0.86 MMP13 (0.61) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL6256249 0.86 MMP13 (0.61) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL6241901 0.84 CNR2 (0.56) MMP13SLC22A8PARGHDAC1HPD
SCHEMBL7019308 0.84 MMP13 (0.59) MMP13SLC22A8PARGHDAC1

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 315/4885PARG 3624/4885

“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.