SCHEMBL6843440

SCHEMBL6843440

O=C(O)c1ccc(Cc2c(O)cc3ccc(C(=O)OCc4ccc(I)cc4)cc3c2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
LMNA P02545 2/20 0.38
TPMT P51580 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A3 Q01959 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PIM1 P11309 1/20 0.34
FOLH1 Q04609 1/20 0.34

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
SCHEMBL6195785 0.91 LMNA (0.48) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6843319 0.89 SRD5A2 (0.43) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6843367 0.89 RXRA (0.43) RXRARXRBKMT2AMEN1NPC1
SCHEMBL6842430 0.89 MAPT (0.44) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6838144 0.89 NR4A2 (0.43) RXRARXRBKMT2AMEN1NPC1
SCHEMBL6845496 0.88 MAPT (0.42) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6211990 0.88 PTPN5 (0.47) RXRARXRBKMT2AMEN1NPC1
SCHEMBL6843437 0.87 CA1 (0.48)
SCHEMBL6842988 0.87 CA1 (0.38) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6845480 0.87 SRD5A2 (0.46) RXRARXRBKMT2AMEN1ALDH1A1

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.