SCHEMBL7187512

SCHEMBL7187512

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

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.47
ESR2 Q92731 10/20 0.47
ME2 P23368 1/20 0.39
ME1 P48163 1/20 0.39
ME3 Q16798 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
APP P05067 1/20 0.39
LTA4H P09960 1/20 0.38
P2RY10 O00398 1/20 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
SCHEMBL7193824 0.92 ESR1 (0.47) ESR1ESR2TDP1ALDH1A1
SCHEMBL7189203 0.91 ESR1 (0.47) ESR1ESR2TDP1ALDH1A1P2RY10
SCHEMBL7195102 0.91 CYP4F2 (0.46) ESR1ESR2ALDH1A1
SCHEMBL7195079 0.88 ESR1 (0.49) ESR1ESR2P2RY10
SCHEMBL7186036 0.84 ESR1 (0.49) ESR1ESR2
SCHEMBL7190482 0.84 ESR1 (0.53) ESR1
SCHEMBL7195351 0.83 MAPT (0.47) ESR1ESR2TDP1ALDH1A1
SCHEMBL7189822 0.83 ESR1 (0.52) ESR1ESR2
SCHEMBL7190060 0.82 ESR1 (0.40) ESR1ESR2APP
SCHEMBL7193207 0.81 ESR1 (0.49) ESR1ESR2ALDH1A1

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