SCHEMBL7190482

SCHEMBL7190482

O=C(O)CCc1ccc(Oc2c(-c3ccc(O)cc3)ccc3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.53
FFAR1 O14842 15/20 0.53
AKR1B1 P15121 2/20 0.53
PCNA P12004 1/20 0.50
FFAR4 Q5NUL3 12/20 0.49
SRD5A2 P31213 1/20 0.47

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
SCHEMBL7189113 0.93 FFAR1 (0.57) FFAR1AKR1B1FFAR4SRD5A2
SCHEMBL7187264 0.90 FFAR1 (0.56) FFAR1AKR1B1FFAR4SRD5A2
SCHEMBL7188049 0.90 FFAR1 (0.56) FFAR1AKR1B1FFAR4SRD5A2
SCHEMBL7187252 0.89 ESR1 (0.62) ESR1FFAR1PCNAFFAR4
SCHEMBL7190740 0.88 FFAR1 (0.53) ESR1FFAR1AKR1B1FFAR4
SCHEMBL7195102 0.86 CYP4F2 (0.46) ESR1FFAR1AKR1B1FFAR4
SCHEMBL7190060 0.85 ESR1 (0.40) ESR1FFAR1AKR1B1FFAR4
SCHEMBL7187874 0.85 ESR1 (0.55) ESR1FFAR1PCNAFFAR4
SCHEMBL7187512 0.84 ESR1 (0.47) ESR1
SCHEMBL7188059 0.83 ESR1 (0.55) ESR1FFAR1PCNAFFAR4

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