SCHEMBL7181189

SCHEMBL7181189

CCOC(=O)CCc1ccc(Oc2c(-c3ccc(F)cc3)ccc3cc(O)ccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.52
ESR2 Q92731 12/20 0.52
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
FFAR4 Q5NUL3 2/20 0.42
FFAR1 O14842 1/20 0.42
MAOB P27338 1/20 0.39

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
SCHEMBL7193207 0.94 ESR1 (0.49) ESR1ESR2CYP4F2CYP4A11MAOB
SCHEMBL7181142 0.91 CYP4F2 (0.43) ESR1ESR2CYP4F2CYP4A11FFAR4
SCHEMBL7195159 0.91 ESR1 (0.44) ESR1ESR2CYP4F2CYP4A11FFAR4
SCHEMBL7189095 0.90 ESR1 (0.47) ESR1ESR2CYP4F2CYP4A11
SCHEMBL7190451 0.90 ESR1 (0.55) ESR1ESR2CYP4F2CYP4A11FFAR1
SCHEMBL7188433 0.89 ESR1 (0.48) ESR1ESR2CYP4F2CYP4A11MAOB
SCHEMBL7187993 0.88 ESR1 (0.52) ESR1ESR2CYP4F2CYP4A11FFAR1
SCHEMBL7195082 0.87 ESR1 (0.56) ESR1ESR2FFAR4FFAR1
SCHEMBL7188063 0.86 ESR1 (0.44) ESR1ESR2MAOB
SCHEMBL7189999 0.84 CYP4F2 (0.46) ESR1ESR2CYP4F2CYP4A11FFAR4

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