SCHEMBL7580377

SCHEMBL7580377

O=C(Oc1ccc2c(c1)CC(c1ccccc1)=C2Cc1ccc(OCCN2CCCC2)cc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.51
ESR2 Q92731 4/20 0.51
LTA4H P09960 6/20 0.49
EBP Q15125 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
MCHR1 Q99705 1/20 0.47
HTT P42858 1/20 0.45
PSMB1 P20618 3/20 0.45
PSMB5 P28074 3/20 0.45
PSMB2 P49721 2/20 0.44
KDM4E B2RXH2 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
SCHEMBL7573537 0.99 ESR1 (0.53) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL7574765 0.92 ESR1 (0.57) ESR1ESR2LTA4HHTT
SCHEMBL7581961 0.91 ESR1 (0.59) ESR1ESR2LTA4H
SCHEMBL7572449 0.90 ESR1 (0.52) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL7572321 0.90 ESR1 (0.53) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL8504413 0.85 EBP (0.64) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL7580940 0.85 ESR1 (0.64) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL7571727 0.84 LTA4H (0.51) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL7574347 0.83 LTA4H (0.52) ESR1ESR2LTA4HEBPSIGMAR1
SCHEMBL8588812 0.82 LTA4H (0.41) ESR1ESR2LTA4HMCHR1

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
US-5994370-A ESTROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 1999-11-30 US claimed
EP-0873992-B1 Indene compounds having activity as SERMs LILLY CO ELI (US) 2002-09-25 EP disclosed
US-5994370-A ESTROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 1999-11-30 US disclosed
EP-0873992-A1 Indene compounds having activity as SERMs ELI LILLY AND COMPANY (US) 1998-10-28 EP disclosed