SCHEMBL7189250

SCHEMBL7189250

CCCCCOC(=O)CCCc1ccc(Oc2c(-c3ccc(OC)cc3)ccc3cc(OC)ccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.43
ESR2 Q92731 4/20 0.43
EIF4A1 P60842 1/20 0.41
PTPN11 Q06124 1/20 0.39
NAAA Q02083 1/20 0.38
RARB P10826 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
MAOA P21397 1/20 0.37
SLC6A2 P23975 1/20 0.37
RAB9A P51151 1/20 0.37
SLC6A3 Q01959 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALOX5 P09917 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL7188897 0.94 ESR1 (0.43) ESR1ESR2EIF4A1PTPN11RARB
SCHEMBL7193820 0.91 ALOX5 (0.42) ESR1ESR2EIF4A1KDM4ENPC1
SCHEMBL7186036 0.89 ESR1 (0.49) ESR1ESR2MAOA
SCHEMBL7183821 0.88 TDP1 (0.43) ESR1ESR2PTPN11KDM4ENPC1
SCHEMBL7189999 0.85 CYP4F2 (0.46) ESR1ESR2KDM4ENPC1LMNA
SCHEMBL7187213 0.85 FFAR4 (0.47) ESR1ESR2EIF4A1KDM4ENPC1
SCHEMBL7188063 0.84 ESR1 (0.44) ESR1ESR2MAOAALOX5
SCHEMBL7193824 0.84 ESR1 (0.47) ESR1ESR2NPC1LMNATP53
SCHEMBL7195079 0.84 ESR1 (0.49) ESR1ESR2MAOA
SCHEMBL7182700 0.83 ALDH1A1 (0.43) ESR1ESR2NPC1RAB9AALOX5

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