SCHEMBL7935008

SCHEMBL7935008

Oc1cccc(-c2ccc3ccccc3c2Oc2ccc(NCCN3CCCCC3)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 16/20 0.64
ESR2 Q92731 15/20 0.64
KDR P35968 2/20 0.43
PDGFRB P09619 1/20 0.41
SRC P12931 1/20 0.41

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
SCHEMBL7937061 0.93 ESR1 (0.75) ESR1ESR2
SCHEMBL7935136 0.90 ESR1 (0.60) ESR1ESR2
SCHEMBL7928976 0.88 ESR1 (0.49) ESR1ESR2
SCHEMBL7802407 0.86 ESR1 (0.85) ESR1ESR2KDR
SCHEMBL8399933 0.85 ESR1 (0.54) ESR1ESR2
SCHEMBL7934920 0.85 ESR1 (0.64) ESR1ESR2
Hydrochloric Acid SCHEMBL6050111 0.85 ESR1 (0.84) ESR1ESR2KDR
SCHEMBL7935036 0.84 ESR1 (0.48) ESR1ESR2
SCHEMBL7929009 0.84 ESR1 (0.74) ESR1ESR2
SCHEMBL7934984 0.83 ESR1 (0.72) 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-0835868-B1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods LILLY CO ELI (US) 2001-08-29 EP claimed
EP-0835868-A1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP claimed
EP-0835868-B1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods LILLY CO ELI (US) 2001-08-29 EP disclosed
EP-0835868-A1 2-Aryl-3-aminoaryloxynaphthyl compounds, intermediates, compositions and methods ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed