SCHEMBL7012428

SCHEMBL7012428

CCOC(=O)Oc1cn(Cc2cccc3ccccc23)c2sc(-c3ccc(OC)cc3)c(CN(C)Cc3ccccc3)c2c1=O

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.69

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
SCHEMBL7014057 0.92 GNRHR (0.67) GNRHR
SCHEMBL7008230 0.92 GNRHR (0.81) GNRHR
SCHEMBL7012762 0.90 GNRHR (0.81) GNRHR
SCHEMBL7017648 0.90 GNRHR (0.79) GNRHR
SCHEMBL7008955 0.90 GNRHR (0.83) GNRHR
SCHEMBL7009012 0.89 GNRHR (0.78) GNRHR
SCHEMBL7011725 0.89 GNRHR (0.69) GNRHR
SCHEMBL7010207 0.89 GNRHR (0.69) GNRHR
SCHEMBL7008163 0.89 GNRHR (0.70) GNRHR
SCHEMBL7008589 0.89 GNRHR (0.80) 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-0756599-B1 BICYCLIC THIOPHENE DERIVATIVES AND USE AS GONADOTROPIN RELEASING HORMONE ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-11-26 EP claimed