SCHEMBL6288787

SCHEMBL6288787

CN1C(=O)N(Cc2ccc(C(=O)O)cc2)Cc2oc(C(=O)NCc3ccccc3)nc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.46
SCD O00767 3/20 0.44
TP53 P04637 2/20 0.42
ALDH1A1 P00352 1/20 0.41
MMP13 P45452 1/20 0.41
EGFR P00533 1/20 0.41
SRC P12931 1/20 0.41
PHGDH O43175 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NR1H4 Q96RI1 2/20 0.40
MAPT P10636 1/20 0.40
EPHX2 P34913 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
SCHEMBL6289016 0.93 SCD (0.43) PTGER4SCDALDH1A1MMP13
SCHEMBL6701897 0.91 SCD (0.52) PTGER4SCDTP53ALDH1A1MAPT
SCHEMBL6696978 0.85 PTGER4 (0.46) PTGER4SCDTP53ALDH1A1MMP13
SCHEMBL6288755 0.81 TP53 (0.45) PTGER4TP53ALDH1A1MMP13EGFR
SCHEMBL6289326 0.79 MMP13 (0.43) PTGER4SCDMMP13HDAC6
SCHEMBL6288965 0.77 SCD (0.40) SCDTP53ALDH1A1MAPT
SCHEMBL6696562 0.72 PTGER4 (0.42) PTGER4SCD
SCHEMBL6701922 0.72 SCD (0.36) PTGER4SCDTP53MMP13MAPT
SCHEMBL6696733 0.71 MMP13 (0.49) PTGER4ALDH1A1MMP13NR1H4EPHX2
SCHEMBL6292196 0.70 SCD (0.54) SCDTP53ALDH1A1MAPT

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
WO-2004014916-A1 PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-6949651-B2 Fused bicyclic metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-09-27 US disclosed
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 US disclosed
US-20040034054-A1 Fused bicyclic metalloproteinase inhibitors LINCOLN FOODSERVICE PRODUCTS INC. 2004-02-19 US disclosed
WO-2004014375-A2 FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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-20040034054-A1 Fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 PTGER4 1598/4885SCD 1414/4885TP53 1049/4885
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 PTGER4 1609/4885SCD 2142/4885TP53 452/4885

“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.