SCHEMBL6843478

SCHEMBL6843478

O=C(O)c1ccc(Cc2c(O)cc3ccc(C(=O)NCc4ccc(Cl)cc4)cc3c2O)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.52
NR1H4 Q96RI1 4/20 0.51
POLA1 P09884 2/20 0.47
ALDH1A1 P00352 1/20 0.46
PTPN6 P29350 1/20 0.46
PTPN11 Q06124 1/20 0.46
PTGER4 P35408 3/20 0.45
PTGER2 P43116 1/20 0.45
PPARG P37231 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL6842635 0.91 NR1H4 (0.59) EPHX2NR1H4ALDH1A1PTGER4PTGER2
SCHEMBL6843325 0.89 NR1H4 (0.51) EPHX2NR1H4PTGER4PTGER2PPARG
SCHEMBL6843206 0.89 NR1H4 (0.51) EPHX2NR1H4ALDH1A1PPARG
SCHEMBL6843413 0.89 NR1H4 (0.52) EPHX2NR1H4ALDH1A1PTGER4RAB9A
SCHEMBL6845318 0.89 NR1H4 (0.51) EPHX2NR1H4PTGER4PTGER2PPARG
SCHEMBL6845364 0.88 NR1H4 (0.50) EPHX2NR1H4SMN1; SMN2
SCHEMBL6843010 0.87 NR1H4 (0.48) EPHX2NR1H4PTGER4PPARG
SCHEMBL6844739 0.87 CA2 (0.55) EPHX2NR1H4
SCHEMBL6844731 0.87 NR1H4 (0.48) EPHX2NR1H4
SCHEMBL6842471 0.87 MMP13 (0.54) EPHX2NR1H4ALDH1A1PTGER4MEN1

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 EPHX2 2569/4885NR1H4 1615/4885POLA1 864/4885

“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.