SCHEMBL7035441

SCHEMBL7035441

CC(c1ccc(C(=O)O)cc1)n1c(=O)[nH]c2sc(C#CCc3cccnc3)cc2c1=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
PTAFR P25105 7/20 0.35
TBXAS1 P24557 9/20 0.34
CXCR3 P49682 1/20 0.34
PTGER4 P35408 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL6471589 0.90 MMP13 (0.35) MMP13SLC22A8PTAFRTBXAS1MAPK1
SCHEMBL6471042 0.87 MMP13 (0.36) MMP13SLC22A8PTGER4MAPK1
SCHEMBL6461412 0.86 MMP13 (0.36) MMP13SLC22A8PTGER4MAPK1
SCHEMBL6913360 0.86 PTGER4 (0.41) MMP13SLC22A8PTGER4
SCHEMBL6471978 0.86 MMP13 (0.36) MMP13SLC22A8PTGER4MAPK1
SCHEMBL6912473 0.85 MMP13 (0.38) MMP13SLC22A8PTGER4MAPK1
SCHEMBL6916599 0.85 MMP13 (0.38) MMP13SLC22A8PTGER4ALDH1A1MAPK1
SCHEMBL6736341 0.85 MMP13 (0.39) MMP13SLC22A8CXCR3PTGER4MAPK1
SCHEMBL6733045 0.85 MMP13 (0.37) MMP13SLC22A8ALDH1A1MAPK1KDM4E
SCHEMBL6730190 0.85 MMP13 (0.40) MMP13SLC22A8PTGER4ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US claimed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 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 (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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 MMP13 1/4885SLC22A8 605/4885PTAFR 2979/4885

“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.