SCHEMBL7928773

SCHEMBL7928773

O=C(CN1CCCCC1)Nc1ccc(Oc2c(-c3ccc(O)cc3)ccc3ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
GLA P06280 1/20 0.58
HPGD P15428 3/20 0.56
ESR1 P03372 5/20 0.53
ESR2 Q92731 5/20 0.53
ESRRG P62508 2/20 0.49
KDR P35968 2/20 0.48
GAA P10253 2/20 0.48
KDM4E B2RXH2 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL7937782 0.91 ESR1 (0.66) ALDH1A1MEN1KMT2AGLAHPGD
SCHEMBL7928818 0.90 ESR1 (0.64) ALDH1A1MEN1KMT2AGLAHPGD
SCHEMBL7935209 0.85 ESR1 (0.59) MEN1KMT2AHPGDESR1ESR2
SCHEMBL7928961 0.84 ESR1 (0.67) ALDH1A1MEN1KMT2AGLAHPGD
SCHEMBL7935136 0.83 ESR1 (0.60) ESR1ESR2ESRRG
SCHEMBL7928850 0.82 KDR (0.63) ALDH1A1MEN1KMT2AGLAHPGD
SCHEMBL7928963 0.81 ESR1 (0.69) ALDH1A1ESR1ESR2LMNA
SCHEMBL8401838 0.78 MEN1 (0.55) ALDH1A1MEN1KMT2AGLAHPGD
SCHEMBL8403699 0.78 MEN1 (0.55) ALDH1A1MEN1KMT2AESR1ESR2
SCHEMBL8594720 0.77 MEN1 (0.53) ALDH1A1MEN1KMT2AESR1ESR2

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