SCHEMBL6646325

SCHEMBL6646325

CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)n(-c2ccc(O)cc2)c(=O)n3Cc2c(F)cccc2F)cc1

nearest known ligand 0.92

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.92

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
Sufugolix SCHEMBL209021 0.96 GNRHR (1.00) GNRHR
SCHEMBL782109 0.95 GNRHR (0.93) GNRHR
Sufugolix SCHEMBL4251869 0.95 GNRHR (0.99) GNRHR
SCHEMBL780108 0.95 GNRHR (0.92) GNRHR
SCHEMBL778228 0.92 GNRHR (0.88) GNRHR
SCHEMBL6646171 0.92 GNRHR (0.86) GNRHR
SCHEMBL779784 0.91 GNRHR (1.00) GNRHR
SCHEMBL778402 0.89 GNRHR (0.85) GNRHR
SCHEMBL4885456 0.89 GNRHR (0.86) GNRHR
SCHEMBL778895 0.89 GNRHR (0.85) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1163244-B1 THIENOPYRIMIDINE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-03-10 EP disclosed
US-6340686-B1 GONADOTROPIN-RELEASING HORMONE ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-22 US disclosed
US-6297379-B1 GONADOTROPIN RELEASING HORMONE (GNRH, SOMETIMES CALLED LH-RH (LUTEINIZING HORMONE RELEASING HORMONE)) ANTAGONIZING ACTIVITY, TREATING SEX HORMONE-DEPENDENT DISEASES. TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-02 US disclosed