SCHEMBL25707340

SCHEMBL25707340

COc1cc(CCNC(NC(=O)[C@@H](N)C(C)C)C(C)C)c(OC)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 17/20 0.52
▸ TAAR1 Q96RJ0 3/20 0.46
▸ HTR2C P28335 6/20 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
SCHEMBL25707333 0.90 HTR2A (0.50) HTR2ATAAR1HTR2C
SCHEMBL25283339 0.85 HTR2A (0.55) HTR2ATAAR1HTR2C
SCHEMBL25283338 0.85 HTR2A (0.55) HTR2ATAAR1HTR2C
SCHEMBL25707330 0.81 HTR2A (0.54) HTR2ATAAR1HTR2C
SCHEMBL25707332 0.79 HTR2A (0.56) HTR2ATAAR1HTR2C
SCHEMBL25707146 0.77 HTR2A (0.57) HTR2ATAAR1HTR2C
SCHEMBL25707329 0.76 HTR2A (0.56) HTR2ATAAR1HTR2C
SCHEMBL25238170 0.76 HTR2A (0.61) HTR2ATAAR1HTR2C
SCHEMBL25284692 0.75 HTR2A (0.51) HTR2ATAAR1HTR2C
SCHEMBL25284691 0.75 HTR2A (0.51) HTR2ATAAR1HTR2C

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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