SCHEMBL6843386

SCHEMBL6843386

CS(=O)(=O)c1ccc(COC(=O)c2ccc3ccc(C(O)c4ccc(C(=O)O)cc4)cc3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
CA12 O43570 2/20 0.41
CA14 Q9ULX7 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
MAPT P10636 3/20 0.40
CA4 P22748 1/20 0.39
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 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
AKR1C3 P42330 2/20 0.39
AKR1C2 P52895 2/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL6845362 0.91 CA1 (0.42) CA1CA2CA9CA12CA14
SCHEMBL6842383 0.90 CA1 (0.55) CA1CA2CA9CA12CA14
SCHEMBL6843115 0.89 ALDH1A1 (0.52) CA1CA2CA9CA12CA14
SCHEMBL6843454 0.87 CA12 (0.39) CA1CA2CA9CA12CA14
SCHEMBL6843419 0.87 RXRA (0.43) RXRARXRBMAPTALDH1A1NPC1
SCHEMBL6194312 0.86 MAPT (0.50) RXRAMAPTALDH1A1NPC1LMNA
SCHEMBL6198198 0.85 NPC1 (0.50) CA1CA2RXRARXRBMAPT
SCHEMBL6843051 0.85 MAPT (0.49) RXRARXRBMAPTALDH1A1NPC1
SCHEMBL6844741 0.85 NR4A2 (0.46) RXRARXRBMAPTALDH1A1NPC1
SCHEMBL6843300 0.85 MAPT (0.43) CA1CA2CA9CA12CA14

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 982/4885CA9 508/4885

“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.