SCHEMBL7935119

SCHEMBL7935119

O=C(Oc1ccc2c(Oc3ccc(NCCN4CCCCC4)cc3)c(-c3ccc(O)cc3)ccc2c1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.56
ESR2 Q92731 16/20 0.56
ESRRG P62508 2/20 0.46

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
SCHEMBL8399885 0.89 ESR1 (0.51) ESR1ESR2ESRRG
SCHEMBL7929009 0.86 ESR1 (0.74) ESR1ESR2
SCHEMBL7934984 0.85 ESR1 (0.72) ESR1ESR2
SCHEMBL7928814 0.85 ESR1 (0.64) ESR1ESR2
SCHEMBL7935136 0.85 ESR1 (0.60) ESR1ESR2ESRRG
SCHEMBL7935018 0.84 ESR1 (0.62) ESR1ESR2
SCHEMBL8399890 0.83 ESR1 (0.45) ESR1ESR2
SCHEMBL7928843 0.81 ESR1 (0.66) ESR1ESR2
SCHEMBL7937042 0.81 ESR1 (0.71) ESR1ESR2
SCHEMBL7937061 0.81 ESR1 (0.75) ESR1ESR2

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-0835868-B1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods LILLY CO ELI (US) 2001-08-29 EP claimed
EP-0835868-A1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP claimed
EP-0835868-B1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods LILLY CO ELI (US) 2001-08-29 EP disclosed
EP-0835868-A1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed