SCHEMBL11238622

SCHEMBL11238622

CC(CC(O)c1ccccc1)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
AOC3 Q16853 2/20 0.45
KDM4E B2RXH2 5/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
SIGMAR1 Q99720 1/20 0.44
ADRA2B P18089 2/20 0.43
ADRA2C P18825 2/20 0.43
SLC6A2 P23975 2/20 0.43
HTR2A P28223 2/20 0.43
ADRA1A P35348 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KCNH2 Q12809 2/20 0.43
SLC6A4 P31645 1/20 0.43
OPRK1 P41145 1/20 0.43
TSHR P16473 4/20 0.40
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SLC22A2 O15244 1/20 0.40

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
SCHEMBL13995692 0.80 ADRA2B (0.50) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL13995693 0.80 ADRA2B (0.50) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL6729783 0.78 AOC3 (0.53) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL13024949 0.77 RIPK1 (0.45) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL11658797 0.77 AOC3 (0.54) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL1834929 0.76 TSHR (0.51) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL6054336 0.76 TSHR (0.51) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL1834931 0.76 TSHR (0.51) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL1593286 0.75 TSHR (0.50) LMNAAOC3KDM4EKMT2AMEN1
SCHEMBL10438182 0.75 SIGMAR1 (0.46) LMNAAOC3KDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4313896-A ANTIDEPRESSANTS, PSYCHOTROPIC AGENTS ELI LILLY AND COMPANY (US) 1982-02-02 US disclosed