SCHEMBL7113533

SCHEMBL7113533

CC1=CC(C)(C)Nc2ccc3c(c21)c(=O)oc1cccc(O[Si](C)(C)C(C)(C)C)c13

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 7/20 0.47
▸ AR P10275 2/20 0.37
▸ NR3C1 P04150 16/20 0.37
▸ NR3C2 P08235 1/20 0.35

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
SCHEMBL4169629 0.86 PGR (0.41) PGRARNR3C1
SCHEMBL29918234 0.86 PGR (0.53) PGRARNR3C1NR3C2
SCHEMBL5032324 0.86 PGR (0.53) PGRARNR3C1NR3C2
SCHEMBL6928534 0.79 PGR (0.55) PGRARNR3C1NR3C2
Hydrochloric Acid SCHEMBL6723833 0.78 PGR (0.54) PGRARNR3C1NR3C2
SCHEMBL2393047 0.78 PGR (0.73) PGRARNR3C1NR3C2
SCHEMBL6294955 0.76 PGR (0.52) PGRARNR3C1NR3C2
SCHEMBL13875735 0.74 PGR (0.46) PGRARNR3C1NR3C2
SCHEMBL2394299 0.74 PGR (0.55) PGRARNR3C1NR3C2
SCHEMBL4160644 0.73 AR (0.53) PGRARNR3C1NR3C2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021118728-A2 GLUCOCORTICOID RECEPTOR RADIOLIGANDS AND METHODS FOR THEIR PREPARATION AND USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-06-17 — — WO disclosed
US-6608216-B2 Preparing biaryl atropisomers; chirality transfer from stereogenic center of secondary alcohol to biaryl stereogenic axis via regioselective intramolecular migration ABBOTT LABORATORIES 2003-08-19 — — US disclosed
US-20030073844-A1 Process for the preparation of chiral glucocorticoid receptor agents ABBOTT LABORATORIES 2003-04-17 — — 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-20030073844-A1 Process for the preparation of chiral glucocorticoid receptor agents NR3C1, NR3C2, MC2R PGR 286/4885AR 35/4885NR3C1 1/4885

“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.

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