SCHEMBL4934889

SCHEMBL4934889

CCOC(=O)c1ccc(COCc2cccc3nc(C(=O)OCC)n(COCC[Si](C)(C)C)c(=O)c23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
MAPK10 P53779 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
BLM P54132 1/20 0.37
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.35
PARP1 P09874 1/20 0.34
MAPT P10636 2/20 0.34
ALOX15 P16050 1/20 0.34
TBXAS1 P24557 1/20 0.34

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
SCHEMBL4935725 0.93 MMP13 (0.40) SMN1; SMN2MEN1KMT2ABLMTSHR
SCHEMBL4932747 0.85 ELANE (0.43) SMN1; SMN2MEN1KMT2ABLMTSHR
SCHEMBL4935109 0.83 CASR (0.39) SMN1; SMN2MEN1KMT2ABLMTSHR
SCHEMBL16792476 0.73 KDM4E (0.51) SMN1; SMN2RECQLTSHRALDH1A1NPC1
SCHEMBL5369563 0.73 ELANE (0.42) NPC1MAPT
SCHEMBL4932572 0.72 MMP13 (0.52) SMN1; SMN2RECQLMAPK10TSHRALDH1A1
SCHEMBL17265587 0.71 MMP13 (0.51) SMN1; SMN2RECQLMAPK10ALDH1A1NPC1
SCHEMBL5374515 0.70 NPC1 (0.37) NPC1MAPT
SCHEMBL7823682 0.69 ELANE (0.45) MEN1KMT2ATSHRNPC1HSD17B10
SCHEMBL2822531 0.68 MAPT (0.36) SMN1; SMN2KMT2AALDH1A1NPC1MAPT

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 SMN1; SMN2 4157/4885RECQL 3455/4885MAPK10 2820/4885
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) MMP13, HDAC11, HDAC1 SMN1; SMN2 4356/4885RECQL 4077/4885MAPK10 1124/4885

“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.