SCHEMBL11464952

SCHEMBL11464952

Oc1ccc(CCCNC[C@H](O)c2cccc(O)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
HIF1A Q16665 3/20 0.58
GALR3 O60755 1/20 0.58
SLC16A3 O15427 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ADRB2 P07550 7/20 0.55
ADRB1 P08588 4/20 0.54
ADRB3 P13945 2/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
TSHR P16473 1/20 0.54
ADRA2B P18089 1/20 0.54
ADRA2C P18825 1/20 0.54
NFKB1 P19838 1/20 0.54
DRD1 P21728 1/20 0.54
HTR7 P34969 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
DRD3 P35462 1/20 0.54

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
SCHEMBL11464953 1.00 LMNA (0.58) LMNAHIF1AGALR3SLC16A3MEN1
SCHEMBL11465856 0.90 HIF1A (0.60) LMNAHIF1AGALR3SLC16A3MEN1
SCHEMBL11465855 0.90 HIF1A (0.60) LMNAHIF1AGALR3SLC16A3MEN1
SCHEMBL11467407 0.87 ADRB2 (0.61) ADRB2ADRB1ADRB3KDM4EGAA
SCHEMBL11467406 0.87 ADRB2 (0.61) ADRB2ADRB1ADRB3KDM4EGAA
SCHEMBL10604963 0.87 ADRB2 (0.67) LMNAHIF1AADRB2ADRB1ADRB3
SCHEMBL11467453 0.86 ADRB2 (0.54) LMNAHIF1AGALR3MEN1KMT2A
SCHEMBL11467451 0.86 ADRB2 (0.54) LMNAHIF1AGALR3MEN1KMT2A
Bromide SCHEMBL11470044 0.86 ADRB2 (0.59) ADRB2ADRB1ADRB3KDM4EGAA
Bromide SCHEMBL11470045 0.86 ADRB2 (0.59) ADRB2ADRB1ADRB3KDM4EGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0007716-A1 R-N-(2-phenyl-2-hydroxyethyl)-3-phenylpropyl amines, their formulations, use and preparation ELI LILLY AND COMPANY (US) 1980-02-06 EP claimed
EP-0007716-A1 R-N-(2-phenyl-2-hydroxyethyl)-3-phenylpropyl amines, their formulations, use and preparation ELI LILLY AND COMPANY (US) 1980-02-06 EP disclosed