SCHEMBL6843392

SCHEMBL6843392

O=C(O)c1ccc(Cc2ccc3ccc(C(=O)NCc4ccncc4)cc3c2O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 5/20 0.52
MMP13 P45452 4/20 0.47
EPHX2 P34913 3/20 0.47
NAMPT P43490 2/20 0.46
MAPK1 P28482 2/20 0.46
MAPK3 P27361 1/20 0.46
GAA P10253 1/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45
HTT P42858 1/20 0.45
MAPK14 Q16539 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ROCK2 O75116 1/20 0.44
RPS6KA5 O75582 1/20 0.44
MAP4K4 O95819 1/20 0.44
PRKCG P05129 1/20 0.44
PRKACA P17612 1/20 0.44
RPS6KB1 P23443 1/20 0.44
AKT1 P31749 1/20 0.44
GSK3A P49840 1/20 0.44

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
SCHEMBL6843234 0.90 NR1H4 (0.62) NR1H4MMP13EPHX2GAA
SCHEMBL6843355 0.88 NR1H4 (0.53) NR1H4MMP13EPHX2
SCHEMBL6193266 0.88 NR1H4 (0.53) NR1H4MMP13EPHX2LMNAROCK2
SCHEMBL6843449 0.88 NR1H4 (0.53) NR1H4MMP13EPHX2
SCHEMBL6842501 0.88 NR1H4 (0.54) NR1H4MMP13EPHX2LMNAHTT
SCHEMBL6842510 0.88 EPHX2 (0.54) NR1H4MMP13EPHX2SMN1; SMN2
SCHEMBL6843043 0.87 NR1H4 (0.50) NR1H4MMP13EPHX2MAPK14
SCHEMBL6843264 0.85 NR1H4 (0.50) NR1H4EPHX2NAMPT
SCHEMBL6192574 0.85 KDM4E (0.51) NR1H4MMP13EPHX2HTT
SCHEMBL6838118 0.85 MMP13 (0.55) NR1H4MMP13EPHX2SMN1; SMN2L3MBTL1

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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors LI JIE JACK (US) 2004-03-04 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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors MMP9, MMP8, MMP13 NR1H4 1615/4885MMP13 3/4885EPHX2 2569/4885

“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.