SCHEMBL7208411

SCHEMBL7208411

COCCCn1c(=O)c2c(C)c(-c3ccc(OC)cc3)sc2n(Cc2ccccc2F)c1=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 3/20 0.53
GNRHR P30968 13/20 0.50
TRPC5 Q9UL62 3/20 0.44

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
SCHEMBL7207939 0.89 GNRHR (0.52) ADORA2BGNRHR
SCHEMBL7206328 0.86 GNRHR (0.72) GNRHR
SCHEMBL7851652 0.74 GNRHR (0.51) ADORA2BGNRHR
SCHEMBL7849577 0.73 EDNRB (0.46) ADORA2BGNRHRTRPC5
SCHEMBL7852076 0.72 GNRHR (0.44) ADORA2BGNRHRTRPC5
SCHEMBL7597400 0.71 GNRHR (0.48) ADORA2BGNRHR
SCHEMBL7850471 0.71 GNRHR (0.48) ADORA2BGNRHR
SCHEMBL8164276 0.71 GNRHR (0.60) GNRHR
SCHEMBL7854243 0.71 GNRHR (0.47) ADORA2BGNRHR
SCHEMBL7206967 0.71 GNRHR (0.47) GNRHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0808317-B1 THIENOPYRIMIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-10 EP disclosed
US-6180792-B1 DRUGS, ANTISECRETORY AGENTS AND HORMONE INHIBITORS FOR LH-RH TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-30 US disclosed
US-6048863-A SEXUAL DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-11 US 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-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