SCHEMBL14747826

SCHEMBL14747826

CNC(=O)Nc1ccc(-c2sc3c(c2CN(C)CCN2CCCC2=O)c(=O)n(-c2ccccc2)c(=O)n3Cc2c(F)cccc2F)cc1

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.87

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
SCHEMBL4054646 0.94 GNRHR (0.85) GNRHR
SCHEMBL778579 0.93 GNRHR (1.00) GNRHR
SCHEMBL799696 0.91 GNRHR (0.75) GNRHR
SCHEMBL13721596 0.90 GNRHR (0.79) GNRHR
SCHEMBL780226 0.89 GNRHR (0.93) GNRHR
SCHEMBL13721898 0.89 GNRHR (0.78) GNRHR
SCHEMBL778220 0.89 GNRHR (0.92) GNRHR
SCHEMBL4055110 0.87 GNRHR (0.75) GNRHR
SCHEMBL4255023 0.87 GNRHR (1.00) GNRHR
SCHEMBL778293 0.85 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1591446-B1 Thienopyrimidine compounds and use thereof TAKEDA PHARMACEUTICAL (JP) 2013-03-06 EP disclosed