SCHEMBL4934772

SCHEMBL4934772

NC(=O)c1ccncc1NC(=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.49
KDM4C Q9H3R0 15/20 0.49
KDM6B O15054 7/20 0.49
KDM4D Q6B0I6 6/20 0.49
EGLN3 Q9H6Z9 1/20 0.47
TDP1 Q9NUW8 2/20 0.46
SIRT3 Q9NTG7 1/20 0.46
KDM5B Q9UGL1 2/20 0.46
KDM5A P29375 1/20 0.46
KDM4E B2RXH2 2/20 0.44
KDM4A O75164 2/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTPN1 P18031 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.40

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
SCHEMBL7991807 0.86 KDM4C (0.64) KDM4CKDM6BKDM4DEGLN3TDP1
SCHEMBL29601833 0.81 IRAK4 (0.50) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL18422044 0.81 IRAK4 (0.50) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL29892972 0.80 KDM4C (0.52) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL20339713 0.80 KDM4C (0.57) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL17711000 0.79 KDM4C (0.51) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL2015798 0.79 KDM4D (0.63) IRAK4KDM4CKDM4DTDP1SIRT3
SCHEMBL18421265 0.79 KDM4C (0.51) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL27077511 0.78 KDM4C (0.51) IRAK4KDM4CKDM6BKDM4DEGLN3
SCHEMBL18421178 0.78 TSHR (0.49) IRAK4KDM4CKDM6BKDM4DEGLN3

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
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

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 IRAK4 3130/4885KDM4C 1024/4885KDM6B 1013/4885
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) MMP13, HDAC11, HDAC1 IRAK4 3654/4885KDM4C 1435/4885KDM6B 737/4885

“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.