SCHEMBL6843382

SCHEMBL6843382

CS(=O)(=O)c1ccc(COC(=O)c2ccc3ccc(Cc4ccc(C(=O)O)cc4)c(O)c3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PIM1 P11309 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL6845360 0.91 MEN1 (0.39) MAPTCA12CA1CA2CA4
SCHEMBL6842379 0.90 CA1 (0.49) CA12CA1CA2CA4CA9
SCHEMBL6843114 0.89 ALDH1A1 (0.51) MAPTMEN1KMT2ATSHRALDH1A1
SCHEMBL6843418 0.87 SRD5A2 (0.45) MAPTMEN1KMT2APIM1NPC1
SCHEMBL6843224 0.87 LMNA (0.50) MAPTMEN1KMT2AALDH1A1NPC1
SCHEMBL6843235 0.86 ALDH1A1 (0.48) MAPTMEN1KMT2ATSHRALDH1A1
SCHEMBL6843453 0.86 CA12 (0.40) MAPTCA12CA1CA2CA4
SCHEMBL6844668 0.85 NPC1 (0.49) MAPTCA1CA2MEN1KMT2A
SCHEMBL6843050 0.85 MAPT (0.46) MAPTMEN1KMT2APIM1NPC1
SCHEMBL6844736 0.85 NR4A2 (0.45) MAPTMEN1KMT2APIM1ALDH1A1

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 MAPT 1745/4885CA12 2433/4885CA1 2024/4885

“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.