SCHEMBL7181385

SCHEMBL7181385

COc1ccc2c(Oc3ccc(/C=C/C(=O)O)cc3)c(-c3ccc(Cl)cc3)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 13/20 0.54
ESR2 Q92731 6/20 0.52
THRB P10828 1/20 0.49
ATM Q13315 1/20 0.49
MAOB P27338 3/20 0.47
ABCG2 Q9UNQ0 2/20 0.47
MAOA P21397 1/20 0.46
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL7181393 1.00 ESR1 (0.54) ESR1ESR2THRBATMMAOB
SCHEMBL7184758 0.94 ESR1 (0.58) ESR1ESR2THRBATM
SCHEMBL7184764 0.94 ESR1 (0.58) ESR1ESR2THRBATM
Water SCHEMBL7184036 0.93 ESR1 (0.57) ESR1ESR2THRBATM
Water SCHEMBL7184030 0.93 ESR1 (0.57) ESR1ESR2THRBATM
SCHEMBL7182553 0.90 ESR1 (0.59) ESR1ESR2THRBATM
SCHEMBL7182557 0.90 ESR1 (0.59) ESR1ESR2THRBATM
SCHEMBL7189464 0.90 ESR1 (0.55) ESR1ESR2THRBATM
SCHEMBL7189970 0.90 ESR1 (0.64) ESR1ESR2
SCHEMBL7189967 0.90 ESR1 (0.64) ESR1ESR2

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 4 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
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
EP-0835867-A1 1-Aryloxy-2-arylnaphthyl compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed