SCHEMBL25707338

SCHEMBL25707338

COc1cc(CCNC(C)NC(=O)C(C)(C)C)c(OC)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 19/20 0.52
▸ HTR2C P28335 8/20 0.45
▸ TAAR1 Q96RJ0 2/20 0.45

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
SCHEMBL25707329 0.86 HTR2A (0.56) HTR2AHTR2CTAAR1
SCHEMBL25707332 0.86 HTR2A (0.56) HTR2AHTR2CTAAR1
SCHEMBL25283290 0.82 HTR2A (0.60) HTR2AHTR2CTAAR1
SCHEMBL25707333 0.81 HTR2A (0.50) HTR2AHTR2CTAAR1
SCHEMBL25707336 0.78 HTR2A (0.59) HTR2AHTR2C
SCHEMBL25238170 0.76 HTR2A (0.61) HTR2AHTR2CTAAR1
SCHEMBL25424120 0.74 HTR2A (0.67) HTR2AHTR2CTAAR1
SCHEMBL25244513 0.74 HTR2A (0.58) HTR2AHTR2CTAAR1
SCHEMBL25284691 0.73 HTR2A (0.51) HTR2AHTR2CTAAR1
SCHEMBL25284692 0.73 HTR2A (0.51) HTR2AHTR2CTAAR1

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-2023115002-A1 ANALOGS OF 4-BROMO-2,5-DIMETHOXYPHENETHYLAMINE TERRAN BIOSCIENCES INC. (US) 2023-06-22 — — WO disclosed
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