SCHEMBL26307482

SCHEMBL26307482

CN(C)Cc1c[nH]c2cccc(O[Si](C)(C)C(C)(C)C)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 10/20 0.55
HTR2C P28335 6/20 0.55
HTR2B P41595 6/20 0.55
HTR6 P50406 2/20 0.50
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HTR1A P08908 2/20 0.44
DRD1 P21728 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
HTR1E P28566 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 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
SCHEMBL30928245 0.87 HTR6 (0.68) HTR2AHTR2CHTR2BHTR6HTR1A
SCHEMBL25074718 0.87 HTR6 (0.68) HTR2AHTR2CHTR2BHTR6HTR1A
SCHEMBL10688869 0.82 HTR6 (0.50) HTR2AHTR6KDM4EMEN1ALDH1A1
SCHEMBL29445150 0.80 HTR6 (0.74) HTR2AHTR2CHTR2BHTR6KDM4E
SCHEMBL13390751 0.80 HTR6 (0.74) HTR2AHTR2CHTR2BHTR6KDM4E
SCHEMBL6983069 0.80 GAA (0.56) HTR2AHTR2CHTR2BHTR6KDM4E
SCHEMBL24723796 0.79 HTR2A (0.38) HTR2AHTR2CHTR2BHTR6KDM4E
SCHEMBL15324144 0.77 MTNR1A (0.52) HTR2AHTR2CHTR2BHTR6MEN1
SCHEMBL15678352 0.75 HTR2A (0.56) HTR2AHTR2CHTR2BHTR6KDM4E
SCHEMBL30681600 0.75 HTR6 (0.73) HTR2AHTR2CHTR2BHTR6HTR1A

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