SCHEMBL61743

SCHEMBL61743

Cn1c(C#N)ccc1-c1ccc2c(c1)C(C)(C)OC(=O)N2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 20/20 1.00
AR P10275 3/20 0.60
NR3C1 P04150 2/20 0.60
NR3C2 P08235 2/20 0.60

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
SCHEMBL4185522 0.99 PGR (0.98) PGRARNR3C1NR3C2
SCHEMBL13579113 0.87 PGR (0.77) PGRARNR3C1NR3C2
SCHEMBL5524424 0.86 PGR (0.76) PGRARNR3C1NR3C2
Tanaproget SCHEMBL62188 0.86 PGR (1.00) PGRNR3C1
SCHEMBL7686696 0.85 PGR (0.74) PGRARNR3C1NR3C2
SCHEMBL1224081 0.85 PGR (1.00) PGRARNR3C1NR3C2
SCHEMBL5518269 0.85 PGR (0.74) PGRARNR3C1NR3C2
SCHEMBL5515556 0.84 PGR (0.72) PGRARNR3C1NR3C2
SCHEMBL5514404 0.84 PGR (0.72) PGRARNR3C1NR3C2
SCHEMBL5515576 0.84 PGR (0.72) 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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476262-B2 Cyanopyrroles WYETH LLC (US) 2013-07-02 US claimed
US-8129523-B2 Coupling process for generating reactive boron-containing derivatives of N-substituted pyrrole-2-carbonitriles to produce biaryls WYETH LLC (US) 2012-03-06 US claimed
EP-1173433-B1 CYANOPYRROLES AS PROGESTERONE RECEPTOR AGONISTS WYETH CORP (US) 2005-12-28 EP claimed
WO-2014159377-A1 COMPOSITIONS CONTAINING TANAPROGET AND NATURAL ESTROGENS TEVA WOMEN'S HEALTH, INC. (US) 2014-10-02 WO disclosed
US-8796266-B2 Cyclothiocarbamate derivatives as progesterone receptor modulators WYETH LLC (US) 2014-08-05 US disclosed
US-20140194398-A1 Tanaproget Compositions Containing Ethinyl Estradiol WYETH LLC (US) 2014-07-10 US disclosed
US-8664208-B2 Tanaproget compositions containing ethinyl estradiol WYETH LLC (US) 2014-03-04 US disclosed
US-8609712-B2 Purification of progesterone receptor modulators WYETH LLC (US) 2013-12-17 US disclosed
US-20130261112-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators WYETH LLC 2013-10-03 US disclosed
US-8476262-B2 Cyanopyrroles WYETH LLC (US) 2013-07-02 US disclosed
US-8466146-B2 Cyclothiocarbamate derivatives as progesterone receptor modulators WYETH LLC (US) 2013-06-18 US disclosed
WO-2005104711-A2 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2005-11-10 WO disclosed
US-20050250766-A1 Purification of progesterone receptor modulators WYETH (US) 2005-11-10 US disclosed
US-20050227971-A1 Thioamide derivatives as progesterone receptor modulators WYETH (US) 2005-10-13 US disclosed
US-20030158182-A1 A progesterone receptor antagonist for providing progestational therapy, treating cancer of breast, uterine, ovarian, endometrial, or prostate, providing contraceptives, hormone replacement therapy WYETH 2003-08-21 US disclosed
US-20030092711-A1 Contraceptives; hormone replacement therapy WYETH LLC 2003-05-15 US disclosed
US-6562857-B2 Progesterone receptor antagonist; inhibiting breast, uterine, ovarian, endometrial, or prostate cancer WYETH 2003-05-13 US disclosed
US-6436929-B1 3,1-BENZOXAZINE-2-THIONES; CONTRACEPTION AND THE TREATMENT OF PROGESTERONE-RELATED MALADIES WYETH 2002-08-20 US disclosed
US-6407101-B1 PROGESTERONE RECEPTOR ANTAGONISTS; CONTRACEPTIVES, HORMONE REPLACEMENT THERAPY; BREAST AND PROSTATE CANCER TREATMENT; MENOPAUSE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed
US-20020068735-A1 Cyanopyrroles AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 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 (6 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-20050227971-A1 Thioamide derivatives as progesterone receptor modulators PGR, PGRMC2, PGRMC1 PGR 1/4885AR 69/4885NR3C1 33/4885
US-20020068735-A1 Cyanopyrroles PGR, NR3C2, GNRHR PGR 1/4885AR 28/4885NR3C1 19/4885
US-20030092711-A1 Contraceptives; hormone replacement therapy PGR, GNRHR, GHRHR PGR 1/4885AR 31/4885NR3C1 14/4885
US-20130261112-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators PGR, PGRMC2, PGRMC1 PGR 1/4885AR 97/4885NR3C1 17/4885
US-20030158182-A1 A progesterone receptor antagonist for providing progestational therapy, treating cancer of breast, uterine, ovarian, endometrial, or prostate, providing contraceptives, hormone replacement therapy PGR, GNRHR, AR PGR 1/4885AR 3/4885NR3C1 27/4885
US-20050250766-A1 Purification of progesterone receptor modulators PGR, PGRMC1, PGRMC2 PGR 1/4885AR 22/4885NR3C1 30/4885

“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.