SCHEMBL6208641

SCHEMBL6208641

CCOC(=O)C1(C(=O)OCC)CCCN1c1ccc(Oc2ccc3c(cnn3-c3ccc(C#N)cc3)c2)nc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.44
PGR P06401 1/20 0.37
SCN7A Q01118 5/20 0.36
KCNH2 Q12809 4/20 0.36
KDM4E B2RXH2 1/20 0.36
P2RX3 P56373 1/20 0.36
SMO Q99835 2/20 0.35
SCN9A Q15858 2/20 0.35
USP14 P54578 2/20 0.35
SCN5A Q14524 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN8A Q9UQD0 1/20 0.35
NR3C1 P04150 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
SCHEMBL6210890 0.90 MMP13 (0.47) MMP13SMONR3C1
SCHEMBL6327815 0.88 MMP13 (0.52) MMP13SCN7AKCNH2KDM4EP2RX3
SCHEMBL6208380 0.86 SMO (0.41) MMP13SMOSCN9ANR3C1
SCHEMBL6211896 0.86 MMP13 (0.41) MMP13SCN7AKCNH2SCN9A
SCHEMBL6207960 0.81 MMP13 (0.64) MMP13PGRSCN7AKCNH2SCN5A
SCHEMBL6202656 0.80 MMP13 (0.70) MMP13KDM4EP2RX3
SCHEMBL6209292 0.77 PGR (0.41) PGRKDM4EP2RX3SMONR3C1
SCHEMBL6328225 0.77 MMP13 (0.60) MMP13SCN9A
SCHEMBL6204333 0.77 MMP13 (0.48) MMP13SCN9A
SCHEMBL6202053 0.75 MMP13 (0.72) MMP13SCN9A

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-1501833-B1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-11-02 EP disclosed
US-6900201-B2 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. (US) 2005-05-31 US disclosed
EP-1501833-A1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2005-02-02 EP disclosed
US-20040010141-A1 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. 2004-01-15 US disclosed
WO-2003091258-A1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2003-11-06 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 (1 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-20040010141-A1 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP9, MMP8, MMP2 MMP13 14/4885PGR 415/4885SCN7A 3164/4885

“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.