SCHEMBL6843413

SCHEMBL6843413

Cc1ccc(CNC(=O)c2ccc3cc(O)c(Cc4ccc(C(=O)O)cc4)c(O)c3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 7/20 0.52
EPHX2 P34913 5/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HASPIN Q8TF76 1/20 0.44
MAPK14 Q16539 1/20 0.44
PTGER4 P35408 1/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
SRD5A2 P31213 1/20 0.43
SELL P14151 1/20 0.43
SELP P16109 1/20 0.43
SELE P16581 1/20 0.43
MMP13 P45452 1/20 0.43
LMNA P02545 1/20 0.42

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) NR1H4EPHX2KDM4EPTGER4MAPT
SCHEMBL6843478 0.89 EPHX2 (0.52) NR1H4EPHX2RAB9APTGER4ALDH1A1
SCHEMBL6843206 0.89 NR1H4 (0.51) NR1H4EPHX2ALDH1A1SELLSELP
SCHEMBL6845318 0.89 NR1H4 (0.51) NR1H4EPHX2PTGER4MAPTSELL
SCHEMBL6843325 0.89 NR1H4 (0.51) NR1H4EPHX2PTGER4SELLSELP
SCHEMBL6842471 0.89 MMP13 (0.54) NR1H4EPHX2NPC1RAB9APTGER4
SCHEMBL6845364 0.88 NR1H4 (0.50) NR1H4EPHX2HTTMAPK14SELL
SCHEMBL6845405 0.88 RORC (0.49) NR1H4EPHX2ALDH1A1
SCHEMBL6844739 0.87 CA2 (0.55) NR1H4EPHX2
SCHEMBL6843010 0.87 NR1H4 (0.48) NR1H4EPHX2MAPK14PTGER4SRD5A2

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 1615/4885EPHX2 2569/4885KDM4E 1987/4885

“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.