SCHEMBL6449388

SCHEMBL6449388

Cc1cc(C2(c3cc(C)c(O)c(Cl)c3)CC(CC(C)(C)C)C2C)cc(Cl)c1O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.33
MAOA P21397 1/20 0.31

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
SCHEMBL6449390 1.00 ACHE (0.33) ACHEMAOA
SCHEMBL6449386 1.00 ACHE (0.33) ACHEMAOA
SCHEMBL6056650 0.92 ESR1 (0.37)
SCHEMBL6056645 0.92 ESR1 (0.37)
SCHEMBL6056641 0.92 ESR1 (0.37)
SCHEMBL6449774 0.80 CA1 (0.33)
SCHEMBL6449784 0.80 CA1 (0.33)
SCHEMBL6449782 0.80 CA1 (0.33)
SCHEMBL6447971 0.78 ESR1 (0.45)
SCHEMBL6056809 0.78 ESR1 (0.45)

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-20050148570-A1 Novel substituted alkane compounds and uses thereof HUANG LIREN (US) 2005-07-07 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-20050148570-A1 Novel substituted alkane compounds and uses thereof ALK, CYP11B2, ALKBH2 ACHE 3816/4885MAOA 1426/4885

“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.