SCHEMBL6843010

SCHEMBL6843010

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

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 4/20 0.48
MAPK14 Q16539 1/20 0.47
EPHX2 P34913 4/20 0.47
LSS P48449 1/20 0.47
PTGER4 P35408 5/20 0.46
SRD5A2 P31213 1/20 0.46
MMP13 P45452 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
KDM1A O60341 2/20 0.44
HDAC1 Q13547 2/20 0.44
RORC P51449 1/20 0.43

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
SCHEMBL6845318 0.89 NR1H4 (0.51) NR1H4EPHX2PTGER4MMP13PPARG
SCHEMBL6842635 0.89 NR1H4 (0.59) NR1H4EPHX2PTGER4MMP13HDAC1
SCHEMBL6845364 0.88 NR1H4 (0.50) NR1H4MAPK14EPHX2MMP13
SCHEMBL6838326 0.87 EPHX2 (0.50) NR1H4MAPK14EPHX2PTGER4PPARG
SCHEMBL6843413 0.87 NR1H4 (0.52) NR1H4MAPK14EPHX2PTGER4SRD5A2
SCHEMBL6843325 0.87 NR1H4 (0.51) NR1H4EPHX2PTGER4MMP13PPARG
SCHEMBL6843478 0.87 EPHX2 (0.52) NR1H4EPHX2PTGER4PPARG
SCHEMBL6843206 0.87 NR1H4 (0.51) NR1H4EPHX2MMP13PPARGHDAC1
SCHEMBL6843043 0.86 NR1H4 (0.50) NR1H4MAPK14EPHX2LSSPTGER4
SCHEMBL6844739 0.84 CA2 (0.55) NR1H4EPHX2

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 1615/4885MAPK14 1562/4885EPHX2 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.