SCHEMBL6843319

SCHEMBL6843319

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.43
MAPT P10636 2/20 0.41
DPP4 P27487 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
LMNA P02545 1/20 0.38
PTPN5 P54829 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL6195785 0.91 LMNA (0.48) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6211990 0.90 PTPN5 (0.47) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6843440 0.89 RXRA (0.43) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6843367 0.89 RXRA (0.43) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6842430 0.89 MAPT (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6838144 0.89 NR4A2 (0.43) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6845496 0.88 MAPT (0.42) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6843453 0.88 CA12 (0.40) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6842988 0.87 CA1 (0.38) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL6843437 0.87 CA1 (0.48)

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 SRD5A2 254/4885MAPT 1745/4885DPP4 818/4885

“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.