SCHEMBL6013810

SCHEMBL6013810

CC(O)(Cc1ccccc1)c1cc(-c2cccc(Cl)c2)ccc1N

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGR P06401 7/20 0.67
TAAR1 Q96RJ0 2/20 0.43
MAOB P27338 2/20 0.40
AOC3 Q16853 1/20 0.39
ESR2 Q92731 1/20 0.38
GRIN2B Q13224 1/20 0.38
ALOX5 P09917 1/20 0.38
GGPS1 O95749 1/20 0.37
FFAR1 O14842 1/20 0.37
SHMT1 P34896 1/20 0.37
SHMT2 P34897 1/20 0.37
KIF11 P52732 1/20 0.36

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
SCHEMBL6770087 0.81 PGR (1.00) PGRTAAR1MAOBESR2ALOX5
SCHEMBL4367637 0.74 PGR (0.70) PGRTAAR1MAOBESR2ALOX5
SCHEMBL4352812 0.72 PGR (0.60) PGRTAAR1MAOBESR2ALOX5
SCHEMBL4357762 0.71 PGR (0.67) PGRTAAR1MAOBESR2ALOX5
SCHEMBL4540489 0.70 PGR (0.65) PGRTAAR1MAOBESR2ALOX5
SCHEMBL20781937 0.70 TAAR1 (0.62) PGRTAAR1MAOBESR2ALOX5
SCHEMBL18014701 0.68 TAAR1 (0.50) PGRTAAR1MAOBAOC3ESR2
SCHEMBL7489944 0.68 DHFR (0.49) PGRTAAR1MAOB
SCHEMBL279178 0.67 PGR (0.51) PGRTAAR1ALOX5
SCHEMBL7496853 0.66 PGR (0.55) PGRTAAR1MAOBESR2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796266-B2 Cyclothiocarbamate derivatives as progesterone receptor modulators WYETH LLC (US) 2014-08-05 US disclosed
US-20130261112-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators WYETH LLC 2013-10-03 US disclosed
US-8466146-B2 Cyclothiocarbamate derivatives as progesterone receptor modulators WYETH LLC (US) 2013-06-18 US disclosed
US-20130072480-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators WYETH LLC (US) 2013-03-21 US disclosed
US-7081457-B2 Contraceptives; hormone replacement therapy WYETH (US) 2006-07-25 US disclosed
US-6759408-B2 CYCLIC COMBINATION THERAPIES AND REGIMENS UTILIZING SUBSTITUTED INDOLINE DERIVATIVE COMPOUNDS WHICH ARE ANTAGONISTS OF THE PROGESTERONE RECEPTOR WYETH 2004-07-06 US disclosed
US-6566358-B2 1,4-dihydro-benzo(d)oxazin-2-one derivatives useful for treating hormone-dependent neoplastic disease is selected from uterine myometrial fibroids, endometriosis, benign prostatic hypertrophy, carcinomas, and adenocarcinoma WYETH 2003-05-20 US disclosed
US-20030092711-A1 Contraceptives; hormone replacement therapy WYETH LLC 2003-05-15 US disclosed
US-20030045511-A1 Combination regimens using progesterone receptor modulators WYETH 2003-03-06 US disclosed
US-6444668-B1 IN COMBINATION WITH A PROGESTIN, AN ESTROGEN, OR BOTH; ANTIPROGESTIN IS A 1,4-DIHYDRO-BENZO(D)(1.3)OXAZIN-2-ONE WYETH 2002-09-03 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-20020049204-A1 Cyclocarbamate derivatives as progesterone receptor modulators WYETH 2002-04-25 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 (5 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-20030045511-A1 Combination regimens using progesterone receptor modulators GNRHR, PGR, PRLHR PGR 2/4885TAAR1 114/4885MAOB 2571/4885
US-20030092711-A1 Contraceptives; hormone replacement therapy PGR, GNRHR, GHRHR PGR 1/4885TAAR1 379/4885MAOB 654/4885
US-20130072480-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators PGR, PGRMC2, PGRMC1 PGR 1/4885TAAR1 287/4885MAOB 3456/4885
US-20130261112-A1 Cyclothiocarbamate Derivatives as Progesterone Receptor Modulators PGR, PGRMC2, PGRMC1 PGR 1/4885TAAR1 287/4885MAOB 3456/4885
US-20020049204-A1 Cyclocarbamate derivatives as progesterone receptor modulators NR3C1, NR5A1, CNR1 PGR 5/4885TAAR1 260/4885MAOB 1537/4885

“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.