SCHEMBL4423985

SCHEMBL4423985

CC1(C)CC(=O)c2ccc(-c3ccc(F)c(Cl)c3)cc21

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGR P06401 14/20 0.76
TDP2 O95551 1/20 0.56
NR3C1 P04150 1/20 0.50
NR3C2 P08235 1/20 0.50
AR P10275 1/20 0.50
ERCC1 P07992 1/20 0.43
ERCC4 Q92889 1/20 0.43
HTR2A P28223 1/20 0.41
GRM2 Q14416 1/20 0.41
PTGS1 P23219 2/20 0.40
PTGS2 P35354 2/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL4429216 0.87 PGR (0.65) PGRTDP2NR3C1NR3C2AR
SCHEMBL4420948 0.87 PGR (1.00) PGRTDP2PTGS2
SCHEMBL4426105 0.86 PGR (0.78) PGRTDP2
SCHEMBL4419225 0.84 PGR (0.78) PGRTDP2
SCHEMBL4418587 0.81 PGR (0.70) PGRTDP2PTGS2
SCHEMBL4418534 0.81 PGR (1.00) PGRTDP2
SCHEMBL4421129 0.80 PGR (0.72) PGRTDP2
SCHEMBL5117896 0.80 PGR (0.49) PGRTDP2NR3C1NR3C2AR
SCHEMBL5117891 0.80 PGR (0.49) PGRTDP2NR3C1NR3C2AR
SCHEMBL4420953 0.79 PGR (0.77) PGRTDP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325916-A1 5-ARYL INDAN-1-ONE AND ANALOGS USEFUL AS PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2009-12-31 US disclosed
US-20080119537-A1 5-Aryl indan-1 one and analogs useful as progesterone receptor modulators WYETH (US) 2008-05-22 US disclosed
US-7319152-B2 Contraception, hormone replacement therapy, cycle-related symptoms, or benign or malignant neoplastic disease; -methyl-5-(5-oxo-5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrole-2-carbonitrile WYETH (US) 2008-01-15 US disclosed
US-20070066675-A1 5-Aryl-indan-1-one 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 (3 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-20070066675-A1 5-Aryl-indan-1-one and analogs useful as progesterone receptor modulators PGR, CYP19A1, GNRHR PGR 1/4885TDP2 4111/4885NR3C1 55/4885
US-20090325916-A1 5-ARYL INDAN-1-ONE AND ANALOGS USEFUL AS PROGESTERONE RECEPTOR MODULATORS CYP19A1, PGR, NR5A1 PGR 2/4885TDP2 4497/4885NR3C1 61/4885
US-20080119537-A1 5-Aryl indan-1 one and analogs useful as progesterone receptor modulators CYP19A1, PGR, NR5A1 PGR 2/4885TDP2 4352/4885NR3C1 54/4885

“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.