SCHEMBL11709671

SCHEMBL11709671

CC(C)(N)Cc1ccc(CCc2ccccc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.83
TAAR1 Q96RJ0 2/20 0.83
MAOB P27338 6/20 0.58
MAOA P21397 4/20 0.58
HTR2A P28223 3/20 0.57
SLC6A4 P31645 1/20 0.57
HRH1 P35367 1/20 0.57
HTR2B P41595 1/20 0.57
CHRNA4 P43681 1/20 0.57
SLC6A3 Q01959 1/20 0.57
LMNA P02545 1/20 0.47
CYP2D6 P10635 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
HIF1A Q16665 1/20 0.45
GHSR Q92847 2/20 0.45
CYP2A6 P11509 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
GFER P55789 1/20 0.42
AOC3 Q16853 1/20 0.42
FFAR1 O14842 1/20 0.42

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
Phentermine SCHEMBL10392295 0.91 SLC6A2 (1.00) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL26615 0.91 SLC6A2 (1.00) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL28695767 0.89 SLC6A2 (0.95) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL3676484 0.89 SLC6A2 (0.95) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL41585 0.89 SLC6A2 (0.95) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL28729624 0.89 SLC6A2 (0.95) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL25214698 0.86 SLC6A2 (0.91) SLC6A2TAAR1MAOBMAOAHTR2A
Phentermine SCHEMBL677133 0.86 SLC6A2 (0.91) SLC6A2TAAR1HTR2ASLC6A4HRH1
Phentermine SCHEMBL29261099 0.86 SLC6A2 (0.91) SLC6A2TAAR1HTR2ASLC6A4HRH1
SCHEMBL9467793 0.83 TAAR1 (0.75) SLC6A2TAAR1HTR2ASLC6A4HRH1

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
US-4017543-A ANTIARRHYTHMIA MERCK & CO., INC. (US) 1977-04-12 US disclosed