SCHEMBL7569460

SCHEMBL7569460

CN(Cc1ccccc1)Cc1c(-c2ccc(O)cc2)sc2c1c(=O)c(C(=O)c1ccccc1)cn2Cc1c(F)cccc1F

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.78
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65

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
Hydrochloric Acid SCHEMBL7493979 0.99 GNRHR (0.77) GNRHRMEN1KMT2A
SCHEMBL7008161 0.93 GNRHR (0.81) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7497443 0.91 GNRHR (0.81) GNRHRMEN1KMT2A
SCHEMBL8160999 0.91 GNRHR (0.82) GNRHRMEN1KMT2A
SCHEMBL7011418 0.90 GNRHR (0.73) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7503209 0.90 GNRHR (0.81) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7496524 0.90 GNRHR (0.91) GNRHRMEN1KMT2A
SCHEMBL7012502 0.89 GNRHR (0.80) GNRHR
SCHEMBL7006922 0.89 GNRHR (0.85) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL8165522 0.89 GNRHR (0.79) GNRHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781774-B1 Prolactin production inhibitory agents TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-07-31 EP disclosed
US-6015789-A LUTEINIZING HORMONE RELEASING HORMONE AGONIST AND A LUTEINIZING HORMONE RELEASING HORMONE ANTAGONIST IN COMBINATION, TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-01-18 US disclosed
US-6001850-A HAVING GONADOTROPIN-RELEASING HORMONE ANTAGONISTIC ACTIVITY ARE USEFUL AS PROPHYLACTIC OR THERAPEUTIC AGENTS FOR THE PREVENTION OR TREATMENT OF SEVERAL HORMONE DEPENDENT DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-14 US disclosed
US-5977132-A GALACTORRHEA, HYPERPROLACTINEMIC OVULATION, PROLACTINOMA AND BRAIN TUMORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-02 US disclosed
EP-0906115-A1 COMBINED USE OF GnRH AGONIST AND ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 1999-04-07 EP disclosed
WO-1997040846-A1 COMBINED USE OF GnRH AGONIST AND ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-11-06 WO disclosed
EP-0781774-A2 Prolactin production inhibitory agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-02 EP disclosed