SCHEMBL27366012

SCHEMBL27366012

CCCN(CCC)CCc1ccc(C(C)N(CCc2cccc3cccc(OC)c23)C(C)C)c2cccc(OC)c12

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.37
HTR2A P28223 1/20 0.35
ABCB1 P08183 2/20 0.34
HTR1A P08908 1/20 0.34

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
SCHEMBL27366592 0.82 BCHE (0.49) BCHEHTR2AHTR1A
SCHEMBL31332092 0.82 BCHE (0.49) BCHEHTR2AHTR1A
SCHEMBL27366601 0.80 HTR2A (0.48) BCHEHTR2A
SCHEMBL27366009 0.73 BCHE (0.48) BCHEHTR2AHTR1A
SCHEMBL31332020 0.71 HTR2A (0.51) BCHEHTR2A
SCHEMBL27366016 0.71 HTR2A (0.51) BCHEHTR2A
SCHEMBL27366100 0.71 HTR2A (0.65) BCHEHTR2A
SCHEMBL31332123 0.71 HTR2A (0.65) BCHEHTR2A
SCHEMBL8974349 0.69 ALOX5 (0.47) HTR2A
SCHEMBL31331965 0.68 HTR2A (0.61) HTR2AHTR1A

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-2023230649-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-12-07 WO disclosed