SCHEMBL7496136

SCHEMBL7496136

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

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.82
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68

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
SCHEMBL7827375 0.94 GNRHR (0.85) GNRHRMEN1KMT2A
SCHEMBL7006922 0.91 GNRHR (0.85) GNRHRMEN1KMT2A
SCHEMBL5149294 0.91 GNRHR (0.83) GNRHRMEN1KMT2A
SCHEMBL7497153 0.90 GNRHR (0.85) GNRHRMEN1KMT2A
SCHEMBL7011617 0.90 GNRHR (0.78) GNRHRMEN1KMT2A
SCHEMBL7497630 0.90 GNRHR (0.71) GNRHRMEN1KMT2A
SCHEMBL7007954 0.90 GNRHR (1.00) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7494036 0.89 GNRHR (0.99) GNRHRMEN1KMT2A
SCHEMBL7009439 0.89 GNRHR (0.77) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL8165522 0.88 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 4 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-5977132-A GALACTORRHEA, HYPERPROLACTINEMIC OVULATION, PROLACTINOMA AND BRAIN TUMORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-02 US disclosed
EP-0781774-A2 Prolactin production inhibitory agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-02 EP disclosed