SCHEMBL31456014

SCHEMBL31456014

CCCCc1cc(CCN)c(OC)cc1Br

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.66
TAAR1 Q96RJ0 4/20 0.66
HTR2C P28335 3/20 0.66
HTR2B P41595 2/20 0.47
MAPT P10636 1/20 0.46

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
SCHEMBL31035919 0.87 TAAR1 (0.72) HTR2ATAAR1HTR2CHTR2B
SCHEMBL24959990 0.83 HTR2A (0.68) HTR2ATAAR1HTR2CHTR2B
SCHEMBL29775337 0.82 HTR2A (0.66) HTR2ATAAR1HTR2C
SCHEMBL23326313 0.82 HTR2A (0.66) HTR2ATAAR1HTR2C
SCHEMBL27002092 0.82 TAAR1 (0.70) HTR2ATAAR1HTR2CMAPT
SCHEMBL244435 0.81 HTR2A (0.76) HTR2ATAAR1HTR2CHTR2B
SCHEMBL31731982 0.81 HTR2A (0.70) HTR2ATAAR1HTR2CHTR2B
SCHEMBL27002011 0.80 TAAR1 (0.68) HTR2ATAAR1HTR2C
SCHEMBL5809547 0.80 HTR2A (1.00) HTR2ATAAR1HTR2CHTR2B
SCHEMBL29351348 0.80 HTR2A (1.00) HTR2ATAAR1HTR2CHTR2B

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-2025059373-A1 NOVEL PHENALKYLAMINES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed