SCHEMBL6607141

SCHEMBL6607141

COc1cccc(CNC(=O)c2ccc3c(c2)S(=O)(=O)N(Cc2ccccc2)C(=O)N3C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
THRB P10828 1/20 0.50
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
DRD2 P14416 1/20 0.48
NAMPT P43490 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
FBP1 P09467 1/20 0.48
NPC1 O15118 1/20 0.47
APOBEC3A P31941 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ROCK2 O75116 3/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
PRKACA P17612 1/20 0.47
GSK3A P49840 1/20 0.47

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
SCHEMBL6605189 0.96 MMP13 (0.60) MMP13MAPTKMT2AL3MBTL1THRB
SCHEMBL6512902 0.90 ALDH1A1 (0.53) MAPTKMT2AHPGDDRD2GAA
SCHEMBL6604906 0.87 L3MBTL1 (0.50) MMP13L3MBTL1THRBLMNATDP1
SCHEMBL6606492 0.86 LMNA (0.52) MMP13MAPTTHRBLMNADRD2
SCHEMBL6609494 0.85 LMNA (0.51) MMP13MAPTKMT2ATHRBLMNA
SCHEMBL6605355 0.84 LMNA (0.51) MMP13MAPTTHRBLMNADRD2
SCHEMBL6517676 0.83 MAPT (0.44) MAPTKMT2ALMNA
SCHEMBL6609773 0.82 ALDH1A1 (0.44) MAPTKMT2ATHRBLMNADRD2
SCHEMBL6606914 0.82 ALDH1A1 (0.49) MAPTDRD2GAA
SCHEMBL6470694 0.81 NPC1 (0.51) MMP13MAPTKMT2ATHRBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368327-B1 BENZO THIADIAZINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-10-20 EP claimed
EP-1368327-B1 BENZO THIADIAZINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-10-20 EP 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-6656932-B2 Treating osteoarthritis, rheumatoid arthritis, cancer, inflammation, and heart failure WARNER-LAMBERT COMPANY 2003-12-02 US disclosed
US-20020156069-A1 Benzo thiadiazine matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY 2002-10-24 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 (2 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-20020156069-A1 Benzo thiadiazine matrix metalloproteinase inhibitors MMP15, MMP13, MMP3 MMP13 2/4885MAPT 4336/4885KMT2A 1627/4885
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 MMP13 1/4885MAPT 1774/4885KMT2A 1331/4885

“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.