SCHEMBL14339239

SCHEMBL14339239

CC(=O)C(C)OS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL2781939 0.79 ALDH1A1 (0.50) ALDH1A1TSHRUSP2CA1CA2
SCHEMBL3441094 0.79 ALDH1A1 (0.50) ALDH1A1TSHRUSP2CA1CA2
SCHEMBL4371933 0.79 ALDH1A1 (0.50) ALDH1A1TSHRUSP2CA1CA2
SCHEMBL1485529 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2CA1CA2
SCHEMBL16465564 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2CA14
SCHEMBL9592301 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2
SCHEMBL17210383 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2
SCHEMBL9591753 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2
SCHEMBL20538746 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2CA1CA2
SCHEMBL9590966 0.77 ALDH1A1 (0.48) ALDH1A1TSHRUSP2

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-20070287855-A1 Process for Preparing Fluorinated Molecules BAYER CROPSCIENCE AG (DE) 2007-12-13 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-20070287855-A1 Process for Preparing Fluorinated Molecules HDHD5, CYP8B1, DHCR7 ALDH1A1 214/4885TSHR 2662/4885USP2 774/4885

“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.