SCHEMBL7188049

SCHEMBL7188049

COc1ccc(-c2ccc3ccccc3c2Oc2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.56
FFAR4 Q5NUL3 7/20 0.56
AKR1B1 P15121 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SRD5A2 P31213 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MMP3 P08254 1/20 0.44
PLA2G4A P47712 1/20 0.44

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 0.92 FFAR1 (0.57) FFAR1FFAR4AKR1B1SRD5A2
SCHEMBL7190482 0.90 ESR1 (0.53) FFAR1FFAR4AKR1B1SRD5A2
SCHEMBL7183920 0.89 FFAR1 (0.50) FFAR1FFAR4AKR1B1SRD5A2
SCHEMBL7187264 0.89 FFAR1 (0.56) FFAR1FFAR4AKR1B1SRD5A2
SCHEMBL7183632 0.89 FFAR1 (0.52) FFAR1FFAR4NPC1RAB9AALDH1A1
SCHEMBL7195351 0.87 MAPT (0.47) FFAR1FFAR4NPC1RAB9AMEN1
SCHEMBL7187431 0.86 MMP3 (0.43) FFAR1FFAR4NPC1RAB9AMEN1
SCHEMBL7188059 0.86 ESR1 (0.55) FFAR1FFAR4ALDH1A1
SCHEMBL7193824 0.85 ESR1 (0.47) FFAR1FFAR4NPC1RAB9AALDH1A1
SCHEMBL7187874 0.84 ESR1 (0.55) FFAR1FFAR4NPC1RAB9AALDH1A1

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