SCHEMBL6288949

SCHEMBL6288949

Cn1cc(Cc2ccc(C(=O)O)cc2)c(=O)c2nc(C(=O)NCc3ccccc3)oc21

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.42
MAPT P10636 1/20 0.41
NR1H4 Q96RI1 4/20 0.41
EPHX2 P34913 3/20 0.41
PTGER4 P35408 3/20 0.40
EGFR P00533 1/20 0.40
SRC P12931 1/20 0.40
BRD4 O60885 1/20 0.40
TP53 P04637 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MMP13 P45452 1/20 0.38
MMP8 P22894 1/20 0.38

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
SCHEMBL6289333 0.91 LMNA (0.44) MAPTTP53ALDH1A1
SCHEMBL6484109 0.81 PTGER4 (0.42) PHGDHNR1H4EPHX2PTGER4TP53
SCHEMBL6292189 0.81 POLB (0.46) PHGDHNR1H4EPHX2PTGER4EGFR
SCHEMBL6292153 0.80 EGFR (0.45) PHGDHMAPTNR1H4EPHX2PTGER4
SCHEMBL6292163 0.79 PHGDH (0.44) PHGDHNR1H4EPHX2PTGER4EGFR
SCHEMBL6288888 0.79 CNR2 (0.43) PHGDHNR1H4EPHX2PTGER4EGFR
SCHEMBL6289330 0.78 MMP13 (0.38) ALDH1A1HDAC6MMP13
SCHEMBL6289352 0.77 PLA2G7 (0.38) MAPTTP53ALDH1A1
SCHEMBL6292734 0.76 LMNA (0.47) MAPTTP53ALDH1A1
SCHEMBL6483747 0.74 NR1H4 (0.44) PHGDHMAPTNR1H4EPHX2PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949651-B2 Fused bicyclic metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-09-27 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 (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-20040034054-A1 Fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 PHGDH 2310/4885MAPT 4533/4885NR1H4 1434/4885

“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.