SCHEMBL7189822

SCHEMBL7189822

CCCCCOC(=O)CCc1ccc(Oc2c(-c3cccc(O)c3)ccc3cc(O)ccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.52
ESR2 Q92731 17/20 0.52
PTPN11 Q06124 2/20 0.38

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
SCHEMBL7181210 0.94 ESR1 (0.54) ESR1ESR2
SCHEMBL7195079 0.91 ESR1 (0.49) ESR1ESR2
SCHEMBL7187993 0.90 ESR1 (0.52) ESR1ESR2
SCHEMBL7183821 0.88 TDP1 (0.43) ESR1ESR2PTPN11
SCHEMBL7186036 0.88 ESR1 (0.49) ESR1ESR2
SCHEMBL7190011 0.86 ESR1 (0.50) ESR1ESR2
SCHEMBL7190451 0.85 ESR1 (0.55) ESR1ESR2
SCHEMBL7182660 0.83 ESR1 (0.56) ESR1ESR2
SCHEMBL7187512 0.83 ESR1 (0.47) ESR1ESR2
SCHEMBL7183969 0.83 ESR1 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0835867-B1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2003-12-03 EP claimed