SCHEMBL7188059

SCHEMBL7188059

COc1ccc(-c2ccc3cc(O)ccc3c2Oc2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.55
FFAR1 O14842 6/20 0.51
FFAR4 Q5NUL3 2/20 0.51
ESR2 Q92731 9/20 0.48
PCNA P12004 1/20 0.46
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL7189109 0.94 ESR1 (0.48) ESR1FFAR1FFAR4ESR2ALDH1A1
SCHEMBL7187874 0.94 ESR1 (0.55) ESR1FFAR1FFAR4ESR2PCNA
SCHEMBL7187252 0.94 ESR1 (0.62) ESR1FFAR1FFAR4ESR2PCNA
SCHEMBL7183632 0.93 FFAR1 (0.52) ESR1FFAR1FFAR4KDM4EALDH1A1
SCHEMBL7185982 0.90 FFAR1 (0.50) ESR1FFAR1FFAR4ESR2
SCHEMBL7189366 0.90 ESR1 (0.55) ESR1FFAR1FFAR4ESR2PCNA
SCHEMBL7195082 0.90 ESR1 (0.56) ESR1FFAR1FFAR4ESR2PCNA
SCHEMBL7183659 0.87 ESR1 (0.54) ESR1FFAR4ESR2PCNA
SCHEMBL7181091 0.87 ESR1 (0.48) ESR1FFAR1FFAR4ESR2
SCHEMBL7183696 0.87 FFAR1 (0.51) ESR1FFAR1FFAR4KDM4EMAPT

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 6 patents. 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
US-5916916-A USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. ELI LILLY AND COMPANY (US) 1999-06-29 US claimed
EP-0835867-A1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP claimed
EP-0835867-B1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2003-12-03 EP disclosed
US-5916916-A USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. ELI LILLY AND COMPANY (US) 1999-06-29 US disclosed
EP-0835867-A1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed