SCHEMBL6842923

SCHEMBL6842923

CS(=O)(=O)c1ccc(COC(=O)c2ccc3cc(O)c(Cc4ccc(C(=O)O)cc4)cc3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
CA4 P22748 1/20 0.41
MAPT P10636 1/20 0.40
CA14 Q9ULX7 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TAS2R14 Q9NYV8 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 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
SCHEMBL6843461 0.91 CA1 (0.50) CA1CA2CA12CA9CA4
SCHEMBL6843227 0.91 CA1 (0.39) CA1CA2CA12CA9CA4
SCHEMBL6843366 0.89 ALDH1A1 (0.51) MAPTMEN1KMT2ATAS2R14TSHR
SCHEMBL6192360 0.87 LMNA (0.50) MAPTMEN1KMT2ATSHRALDH1A1
SCHEMBL6193256 0.86 NPC1 (0.50) CA1CA2MAPTMEN1KMT2A
SCHEMBL6843384 0.86 ALDH1A1 (0.48) MAPTMEN1KMT2ATSHRALDH1A1
SCHEMBL6843300 0.86 MAPT (0.43) CA1CA2CA12CA9CA4
SCHEMBL6192665 0.86 NR4A2 (0.49) MAPTMEN1KMT2ATAS2R14RXRA
SCHEMBL6843466 0.85 RXRA (0.48) MAPTMEN1KMT2AALDH1A1RXRA
SCHEMBL6842933 0.85 RXRA (0.48) MAPTMEN1KMT2AALDH1A1RXRA

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 CA1 2024/4885CA2 982/4885CA12 2433/4885

“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.