SCHEMBL7018972

SCHEMBL7018972

Cn1c(=O)n(Cc2ccc(F)c(F)c2)c(=O)c2cc(C(=O)O)ncc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 11/20 0.44
GRIN2B Q13224 11/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
MMP13 P45452 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
PARG Q86W56 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
SCHEMBL7102299 0.91 GRIN1 (0.44) GRIN1GRIN2BMMP13SLC22A8
SCHEMBL7018710 0.89 MMP13 (0.46) MMP13SLC22A8PARG
SCHEMBL7103058 0.88 MMP13 (0.47) MMP13SLC22A8
SCHEMBL7097608 0.86 MAPT (0.47) GRIN1GRIN2BMMP13SLC22A8PARG
SCHEMBL6255569 0.85 MMP13 (0.53) MMP13SLC22A8PARG
SCHEMBL7097739 0.85 MMP13 (0.46) MMP13SLC22A8PARG
SCHEMBL7022157 0.84 MAPT (0.53) PTGDR2MMP13SLC22A8
SCHEMBL7100732 0.83 PIK3CD (0.51) MMP13SLC22A8PARG
SCHEMBL7014083 0.82 MAPK1 (0.55) MMP13SLC22A8
SCHEMBL6466057 0.81 MMP13 (0.57) PTGDR2MMP13SLC22A8PTGS1PTGS2

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 GRIN1 2546/4885GRIN2B 2437/4885PTGDR2 672/4885

“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.