SCHEMBL6730256

SCHEMBL6730256

COC(=O)c1ccc(Cn2c(=O)c3cc(C(=O)NCc4ccc(F)cc4)ccc3n(C)c2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
PPARG P37231 2/20 0.49
EGFR P00533 1/20 0.49
SRC P12931 1/20 0.49
RXFP1 Q9HBX9 2/20 0.48
PARG Q86W56 2/20 0.48
POLB P06746 1/20 0.48
HDAC1 Q13547 1/20 0.47
RORC P51449 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MMP13 P45452 2/20 0.46
TP53 P04637 1/20 0.46
BACE1 P56817 1/20 0.46
P2RX3 P56373 1/20 0.46

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
SCHEMBL6255321 0.92 MAPT (0.54) MAPTPPARGRXFP1POLBMEN1
SCHEMBL6532934 0.91 PPARG (0.56) MAPTPPARGEGFRSRCPARG
SCHEMBL6463989 0.91 MMP13 (0.55) MAPTPPARGEGFRSRCRXFP1
SCHEMBL6465766 0.90 MMP13 (0.55) MAPTPPARGEGFRSRCRXFP1
SCHEMBL27588034 0.90 PARG (0.52) MAPTPARGHDAC1MEN1KMT2A
SCHEMBL6730033 0.90 PARG (0.52) MAPTPPARGEGFRSRCPARG
SCHEMBL7653589 0.89 ALDH1A1 (0.49) MAPTPPARGEGFRSRCPARG
SCHEMBL7021534 0.89 EGFR (0.50) MAPTPPARGEGFRSRCPARG
SCHEMBL6255332 0.87 MMP13 (0.63) MAPTPPARGRXFP1MEN1KMT2A
SCHEMBL6234634 0.86 MMP13 (0.58) MAPTPPARGRXFP1POLBHDAC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US claimed
US-20040019053-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with celecoxib or valdecoxib ROARK WILLIAM HOWARD (US) 2004-01-29 US disclosed
US-20040019054-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with a selective inhibitor of cyclooxygenase-2 that is not celecoxib or valdecoxib ROARK WILLIAM HOWARD (US) 2004-01-29 US disclosed
US-20020193377-A1 Quinazolines as MMP-13 inhibitors ANDRIANJARA CHARLES (FR) 2002-12-19 US 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 (3 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 MAPT 4823/4885PPARG 3301/4885EGFR 942/4885
US-20040019053-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with celecoxib or valdecoxib MMP13, MMP11, MMP10 MAPT 1345/4885PPARG 497/4885EGFR 793/4885
US-20040019054-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with a selective inhibitor of cyclooxygenase-2 that is not celecoxib or valdecoxib MMP13, MMP11, MMP10 MAPT 1774/4885PPARG 680/4885EGFR 1313/4885

“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.