SCHEMBL6510481

SCHEMBL6510481

C=CCn1c(=O)c2cc(C(=O)O)ccc2n(C)c1=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 3/20 0.46
MAPT P10636 1/20 0.44
ADORA2B P29275 2/20 0.44
HPGD P15428 1/20 0.43
PARG Q86W56 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TBXAS1 P24557 1/20 0.41
PTGER4 P35408 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PARP1 P09874 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
SCHEMBL6242777 0.82 MMP13 (0.49) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL6242785 0.82 MMP13 (0.49) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL6241073 0.80 MMP13 (0.71) MMP13SLC22A8KDM4EALDH1A1HPGD
SCHEMBL7099515 0.79 TBXAS1 (0.43) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL7099516 0.79 TBXAS1 (0.43) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL6510783 0.79 KDM4E (0.59) MMP13SLC22A8KDM4EALDH1A1HPGD
SCHEMBL6513615 0.79 MMP13 (0.58) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL7100616 0.78 MMP13 (0.62) MMP13SLC22A8KDM4EALDH1A1MAPT
SCHEMBL6253605 0.78 MMP13 (0.62) MMP13SLC22A8KDM4EMAPTPARG
SCHEMBL7103427 0.77 MAPT (0.55) MMP13KDM4EALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004126-A1 Method of determining potential allosterically-binding matrix metalloproteinase inhibitors ANDRIANJARA CHARLES (FR) 2005-01-06 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-20050004126-A1 Method of determining potential allosterically-binding matrix metalloproteinase inhibitors MMP13, MMP12, MMP25 MMP13 1/4885SLC22A8 1655/4885KDM4E 2484/4885

“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.