SCHEMBL24809090

SCHEMBL24809090

CCc1cc(CC)c(CCN)cc1CC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 8/20 0.56
BACE1 P56817 1/20 0.47
MEN1 O00255 2/20 0.42
RAD52 P43351 2/20 0.42
RECQL P46063 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
GAPDH P04406 1/20 0.42
THRB P10828 1/20 0.42
APEX1 P27695 1/20 0.42
BLM P54132 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
AGO2 Q9UKV8 1/20 0.41
HTR1A P08908 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 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
SCHEMBL22343336 0.80 TAAR1 (0.44) TAAR1BACE1MEN1RAD52RECQL
SCHEMBL15947157 0.79 TAAR1 (0.67) TAAR1BACE1MAPTHTR1AHTR1D
SCHEMBL3205225 0.78 GRIN2D (0.50) TAAR1BACE1ALOX15GRIN2DGRIN3B
SCHEMBL12797844 0.77 GRIN2D (0.40) TAAR1BACE1MEN1KMT2ATDP1
SCHEMBL11792898 0.77 GRIN2D (0.40) TAAR1BACE1MAPTALOX15GRIN2D
SCHEMBL12082097 0.77 GRIN2D (0.40) TAAR1BACE1MEN1KMT2ATDP1
SCHEMBL13846533 0.75 HTR2A (0.46) TAAR1BACE1HTR2A
SCHEMBL1046128 0.75 BACE1 (0.50) TAAR1BACE1MEN1RAD52RECQL
SCHEMBL24422624 0.74 TAAR1 (0.43) TAAR1BACE1MEN1KMT2ATDP1
SCHEMBL5382583 0.74 AR (0.39) TAAR1BACE1MAPTALOX15HSD17B10

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-2022271982-A1 SUBSTITUTED PHENETHYLAMINE FOR TREATING INFLAMMATION AND PSYCHOLOGICAL DISORDERS SYNAPTIVE THERAPEUTICS, LLC (US) 2022-12-29 WO disclosed