SCHEMBL6845387

SCHEMBL6845387

O=C(O)c1ccc(C(O)c2ccc3ccc(C(=O)OCc4ccc(I)cc4)cc3c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.46
RXRB P28702 2/20 0.46
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RARA P10276 3/20 0.39
RARB P10826 3/20 0.39
RARG P13631 3/20 0.39
TPMT P51580 1/20 0.39
SRD5A2 P31213 1/20 0.39
PDPK1 O15530 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL6194312 0.90 MAPT (0.50) RXRAKMT2AMAPTNPC1RAB9A
SCHEMBL6844741 0.89 NR4A2 (0.46) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6843051 0.89 MAPT (0.49) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6843419 0.89 RXRA (0.43) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6844635 0.89 RXRA (0.46) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6198198 0.87 NPC1 (0.50) RXRARXRBMAPTNPC1RAB9A
SCHEMBL6843441 0.86 RXRA (0.44) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6838252 0.86 ALDH1A1 (0.53) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6845362 0.86 CA1 (0.42) RXRARXRBKMT2AMEN1MAPT
SCHEMBL6843023 0.86 RXRA (0.47) RXRARXRBMAPTALDH1A1SRD5A2

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 RXRA 2850/4885RXRB 2848/4885KMT2A 4149/4885

“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.