SCHEMBL26307653

SCHEMBL26307653

CCCC(=O)OCOc1cccc2[nH]cc(CCN(C)C)c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.61
HTR2A P28223 8/20 0.60
HTR1A P08908 7/20 0.60
HTR2C P28335 6/20 0.60
HTR2B P41595 6/20 0.60
HTR1B P28222 4/20 0.54
HTR1D P28221 2/20 0.54
HTR7 P34969 2/20 0.54
HTR5A P47898 2/20 0.54
DRD1 P21728 1/20 0.54
HTR1E P28566 1/20 0.54
ADORA2A P29274 1/20 0.54
ADORA2B P29275 1/20 0.54
DRD3 P35462 1/20 0.54
HTR1F P30939 1/20 0.49
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
MAOA P21397 1/20 0.46
ADRA1D P25100 1/20 0.46

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
SCHEMBL31666427 1.00 HTR6 (0.61) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL29259496 0.94 HTR6 (0.65) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL26307634 0.94 HTR2A (0.63) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL26307656 0.93 HTR6 (0.64) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL25074645 0.93 HTR6 (0.64) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL25074596 0.90 HTR2A (0.62) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL25074562 0.90 HTR6 (0.62) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL30249003 0.90 HTR2A (0.61) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL26307753 0.90 HTR6 (0.65) HTR6HTR2AHTR1AHTR2CHTR2B
SCHEMBL25074644 0.89 HTR6 (0.62) HTR6HTR2AHTR1AHTR2CHTR2B

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
WO-2023173227-A1 C4-SUBSTITUTED TRYPTAMINE DERIVATIVES AND METHODS OF USING Enveric Biosciences Canada Inc. (CA) 2023-09-21 WO disclosed