SCHEMBL4935798

SCHEMBL4935798

CNC(=O)NCc1cccc(CNC(=O)c2nc3ccccc3c(=O)[nH]2)c1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 19/20 0.63
MMP2 P08253 5/20 0.57
MMP10 P09238 5/20 0.57
MMP8 P22894 5/20 0.57
MMP3 P08254 3/20 0.56
MMP12 P39900 3/20 0.56
MMP1 P03956 2/20 0.56
MMP7 P09237 2/20 0.56
MMP9 P14780 2/20 0.56
MMP14 P50281 2/20 0.56

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
SCHEMBL4926118 0.89 MMP13 (0.59) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4934699 0.89 MMP13 (0.65) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4932534 0.89 MMP13 (0.67) MMP13MMP2MMP10MMP8MMP3
SCHEMBL27683269 0.89 MMP13 (0.67) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4932584 0.86 MMP13 (0.65) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4930061 0.86 MMP13 (0.65) MMP13MMP2MMP10MMP8MMP3
Hydrochloric Acid SCHEMBL4937275 0.85 MMP13 (0.64) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4935082 0.85 MMP13 (0.71) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4936964 0.85 MMP13 (0.61) MMP13MMP2MMP10MMP8MMP3
SCHEMBL4927544 0.85 MMP13 (0.65) MMP13MMP2MMP10MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9475822-B2 Substituted 2- amidoquinazol-4-ones as matrix metalloproteinase-13 inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-10-25 US disclosed
US-9212149-B2 Substituted 2-amidoquinazol-4-ones as matrix metalloproteinase-13 inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-12-15 US disclosed
US-20150329556-A1 SUBSTITUTED 2- AMIDOQUINAZOL-4-ONES AS MATRIX METALLOPROTEINASE-13 INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2015-11-19 US disclosed
EP-1740551-B9 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL (JP) 2013-01-16 EP disclosed
EP-1740551-B1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL (JP) 2012-09-12 EP disclosed
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-31 US disclosed
EP-1740551-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR Takeda Pharmaceutical Company Limited (JP) 2007-01-10 EP disclosed
WO-2005105760-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 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 (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-20150329556-A1 SUBSTITUTED 2- AMIDOQUINAZOL-4-ONES AS MATRIX METALLOPROTEINASE-13 INHIBITORS MMP13, MMP14, MMP25 MMP13 1/4885MMP2 14/4885MMP10 21/4885
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) MMP13, HDAC11, HDAC1 MMP13 1/4885MMP2 16/4885MMP10 19/4885

“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.