SCHEMBL6325359

SCHEMBL6325359

CCOC(=O)C1(C(=O)OCC)CCC(=O)N1c1ccc(Oc2ccc(CO)cc2)nc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 7/20 0.46
P2RX3 P56373 7/20 0.38
IL6 P05231 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
NPBWR1 P48145 1/20 0.36
GPR119 Q8TDV5 1/20 0.35
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL6324181 0.93 MMP13 (0.47) MMP13P2RX3
SCHEMBL6322842 0.91 MMP13 (0.46) MMP13P2RX3ACACBACACAOPRM1
SCHEMBL6326727 0.89 MMP13 (0.46) MMP13P2RX3OPRM1OPRK1
SCHEMBL6326736 0.87 MMP13 (0.45) MMP13P2RX3ACACBACACAOPRM1
SCHEMBL6327769 0.86 MMP13 (0.41) MMP13P2RX3OPRM1OPRK1
SCHEMBL6330448 0.82 USP2 (0.42) MMP13
SCHEMBL6723960 0.76 ALDH1A1 (0.50)
SCHEMBL6731167 0.74 MMP13 (0.58) MMP13
SCHEMBL6727304 0.73 ALDH1A1 (0.48) OPRM1OPRK1
SCHEMBL6724373 0.72 MMP13 (0.46) MMP13OPRM1

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
US-20050159413-A1 Spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors NOE MARK C (US) 2005-07-21 US disclosed
US-6841671-B2 Spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. (US) 2005-01-11 US disclosed
EP-1332146-A2 SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2003-08-06 EP disclosed
US-20030096803-A1 Spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. 2003-05-22 US disclosed
WO-2002034753-A2 SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-05-02 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-20030096803-A1 Spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP9, TIMP3, MMP2 MMP13 39/4885P2RX3 699/4885IL6 123/4885
US-20050159413-A1 Spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP9, TIMP3, MMP8 MMP13 34/4885P2RX3 509/4885IL6 107/4885

“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.