SCHEMBL7967242

SCHEMBL7967242

Cc1cc(C)cc(-c2[nH]c3ncc(C(C)(C)C(=O)O)cc3c2[C@H](C)COCc2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.39

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
SCHEMBL7967244 1.00 GNRHR (0.39) GNRHR
SCHEMBL8012586 0.90 GNRHR (0.49) GNRHR
SCHEMBL7858393 0.90 GNRHR (0.49) GNRHR
SCHEMBL7977562 0.89 GNRHR (0.51) GNRHR
SCHEMBL7977559 0.89 GNRHR (0.51) GNRHR
SCHEMBL8479688 0.85 GNRHR (0.57) GNRHR
SCHEMBL8479692 0.85 GNRHR (0.57) GNRHR
SCHEMBL7847415 0.85 PPARA (0.38)
SCHEMBL7847407 0.85 PPARA (0.38)
SCHEMBL7653947 0.83 PPARA (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6228867-B1 2-PHENYL-PYRROLO(2,3-B)PYRIDINE DERIVATIVES FOR TREATING UROGENITAL AND SLEEP DISORDERS; ANTICARCINOGENIC AGENTS; BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. 2001-05-08 US disclosed
US-6110931-A FOR PREGNANCY PROPHYLAXIS AND TREATMENT OF GLANDULAR DISORDERS, HORMONE DEFICIENCY DISORDERS, GASTROINTESTINAL DISORDERS, GROWTH DISORDERS MERCK & CO., INC. (US) 2000-08-29 US disclosed
US-6077847-A ADMINISTERING A SUBSTITUTED INDOLE COMPOUND TO THE PATIENTS FOR THE TREATMENT OF A VARIETY OF SEX-HORMONE RELATED AND OTHER CONDITIONS IN BOTH MEN AND WOMEN MERCK & CO., INC. (US) 2000-06-20 US disclosed
US-6025366-A Antagonists of gonadotropin releasing hormone MERCK & CO., INC. (US) 2000-02-15 US disclosed
US-5998432-A SEXUAL DISORDERS MERCK & CO., INC. (US) 1999-12-07 US disclosed
US-5985892-A USEFUL FOR THE TREATMENT OF A VARIETY OF SEX-HORMONE RELATED AND OTHER CONDITIONS IN BOTH MEN AND WOMEN; PREVENTING PREGNANCY; TREATING LUPUS ERYTHEMATOSIS, IRRITABLE BOWEL SYNDROME, PREMENSTRUAL SYNDROME, HIRSUTISM, SHORT STATURE OR A MERCK & CO., LTD. (US) 1999-11-16 US disclosed