SCHEMBL7100728

SCHEMBL7100728

Cn1c(=O)n(Cc2ccccc2)c(=O)c2cc(C(=O)CSc3ccncc3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
LMNA P02545 2/20 0.51
HPD P32754 2/20 0.46
PARG Q86W56 6/20 0.45
PKM P14618 2/20 0.44
HDAC1 Q13547 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
PRNP P04156 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
BRAF P15056 1/20 0.41
PIK3CG P48736 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7630566 0.83 MMP13 (0.47) MMP13SLC22A8LMNAHPDPARG
SCHEMBL7106533 0.81 MMP13 (0.59) MMP13SLC22A8HPDPARGHDAC1
SCHEMBL6241073 0.80 MMP13 (0.71) MMP13SLC22A8HPDPARGPKM
SCHEMBL6241901 0.80 CNR2 (0.56) MMP13SLC22A8HPDPARGHDAC1
SCHEMBL6514974 0.79 MMP13 (0.59) MMP13SLC22A8HPDPARGPKM
SCHEMBL7097504 0.77 PARG (0.57) MMP13SLC22A8PARGHDAC1RXFP1
SCHEMBL6245488 0.76 MMP13 (0.60) MMP13SLC22A8HPDPARGPKM
SCHEMBL6517292 0.74 MAPT (0.59) MMP13SLC22A8PARGHDAC1KDM4E
SCHEMBL6244271 0.74 MMP13 (0.58) MMP13SLC22A8LMNAHPDPARG
SCHEMBL6256751 0.74 PARG (0.53) MMP13SLC22A8PARGBRAFPIK3CG

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 6 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 claimed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US claimed
WO-2002064572-A1 QUINAZOLINES AS MMP-13 INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed
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 315/4885LMNA 3812/4885

“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.