SCHEMBL5117896

SCHEMBL5117896

CC1(C)CC(=NO)c2ccc(-c3ccc(F)c(Cl)c3)cc21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGR P06401 12/20 0.49
TDP2 O95551 1/20 0.46
NR3C1 P04150 1/20 0.41
NR3C2 P08235 1/20 0.41
AR P10275 1/20 0.41
ERCC1 P07992 1/20 0.37
ERCC4 Q92889 1/20 0.37
APP P05067 1/20 0.36
BACE1 P56817 1/20 0.36
PTGS2 P35354 3/20 0.36
PTGS1 P23219 1/20 0.36
PIK3CA P42336 1/20 0.35
RPA1 P27694 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
SCHEMBL5117891 1.00 PGR (0.49) PGRTDP2NR3C1NR3C2AR
SCHEMBL5124558 0.88 PGR (0.41) PGRTDP2BACE1PTGS2
SCHEMBL5124405 0.88 PGR (0.63) PGRTDP2APP
SCHEMBL5124566 0.88 PGR (0.41) PGRTDP2BACE1PTGS2
SCHEMBL5124400 0.88 PGR (0.63) PGRTDP2APP
SCHEMBL5113579 0.88 PGR (0.49) PGRTDP2
SCHEMBL5113573 0.88 PGR (0.49) PGRTDP2
SCHEMBL5123320 0.85 PGR (0.50) PGRTDP2APPBACE1
SCHEMBL5123326 0.85 PGR (0.50) PGRTDP2APPBACE1
SCHEMBL5117651 0.83 PGR (0.45) PGRPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414142-B2 5-aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators WYETH (US) 2008-08-19 US disclosed
US-20070066637-A1 5-Aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators WYETH (US) 2007-03-22 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-20070066637-A1 5-Aryl-indan-1-one oximes and analogs useful as progesterone receptor modulators CYP19A1, PGR, GNRHR PGR 2/4885TDP2 4256/4885NR3C1 58/4885

“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.