SCHEMBL25790776

SCHEMBL25790776

CN(C)CCc1onc2cccc(O)c12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.49
HTR2C P28335 12/20 0.44
HTR2B P41595 7/20 0.44
HTR1A P08908 2/20 0.44
DRD1 P21728 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
HTR1E P28566 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
HTR7 P34969 1/20 0.44
DRD3 P35462 1/20 0.44
HTR5A P47898 1/20 0.44
HTR6 P50406 1/20 0.44
TAAR1 Q96RJ0 1/20 0.33

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
SCHEMBL25790527 0.79 HTR6 (0.47) HTR2AHTR2BHTR1AHTR1DHTR1B
SCHEMBL25790532 0.78 CYBB (0.35) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL25790264 0.74 TAAR1 (0.41) HTR2AHTR2CHTR2BHTR1AHTR6
SCHEMBL25790787 0.73 HTR2A (0.49) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL6223143 0.68 ACHE (0.40)
SCHEMBL27366008 0.66 HTR2A (1.00) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL25029606 0.65 HTR2A (0.58) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL30566017 0.64 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL25297732 0.64 HTR2A (0.55) HTR2AHTR2CHTR2BHTR1ADRD1
SCHEMBL36797 0.62 HTR2A (0.65) HTR2AHTR2CHTR2BHTR1ADRD1

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-2023115165-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed