SCHEMBL8893553

SCHEMBL8893553

C[C@H](CCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.69
ADRB2 P07550 7/20 0.66
ALDH1A1 P00352 3/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
ADRB3 P13945 6/20 0.56
ADRB1 P08588 4/20 0.56
CYP2D6 P10635 2/20 0.54
SIGMAR1 Q99720 2/20 0.54
ADRA2A P08913 2/20 0.54
ADRA1D P25100 2/20 0.54
ADRA1A P35348 2/20 0.54
ADRA1B P35368 2/20 0.54
KDM4E B2RXH2 2/20 0.54
LMNA P02545 2/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 2/20 0.54
HTR1A P08908 1/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 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
SCHEMBL8855292 1.00 BCHE (0.69) BCHEADRB2ALDH1A1MEN1KMT2A
SCHEMBL8893543 1.00 BCHE (0.69) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL8893236 0.99 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL8897144 0.99 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL8855297 0.99 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A
SCHEMBL10562541 0.98 BCHE (0.69) BCHEADRB2ALDH1A1MEN1KMT2A
SCHEMBL10562535 0.98 BCHE (0.69) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL11477401 0.96 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL11477403 0.96 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL10564630 0.96 BCHE (0.67) BCHEADRB2ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643967-A ANIMAL GROWTH REGULATORS OF BETA-PHENETHANOLAMINES FOR FEED EFFICIENCY ELI LILLY AND COMPANY (US) 1997-07-01 US disclosed
US-5631298-A B-PHENETHANOLAMINES ELI LILLY AND COMPANY (US) 1997-05-20 US disclosed
US-4992473-A Beta-phenethanolamines ELI LILLY AND COMPANY (US) 1991-02-12 US disclosed
EP-0204948-B1 GROWTH PROMOTION OF ANIMALS WITH PHENETHANOL AMINES ELI LILLY AND COMPANY (US) 1990-03-28 EP disclosed
US-4849453-A ANIMAL GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1989-07-18 US disclosed
US-4734437-A PHENETHANOLAMINES ELI LILLY AND COMPANY (US) 1988-03-29 US disclosed
US-4690951-A B-PHENETHANGLAMINES; FEED EFFICIENCY AND LEANESS ELI LILLY AND COMPANY (US) 1987-09-01 US disclosed
EP-0204948-A1 Growth promotion of animals with phenethanol amines ELI LILLY AND COMPANY (US) 1986-12-17 EP disclosed
EP-0117647-A1 Improvements in or relating to phenethanolamines ELI LILLY AND COMPANY (US) 1984-09-05 EP disclosed
EP-0007205-A1 Optically active phenethanolamines, their formulations, use and preparation ELI LILLY AND COMPANY (US) 1980-01-23 EP disclosed