SCHEMBL4925293

SCHEMBL4925293

NCC1(c2cccc(Br)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.59
MAOB P27338 1/20 0.59
TAAR1 Q96RJ0 1/20 0.59
SLC6A4 P31645 14/20 0.53
SLC6A3 Q01959 13/20 0.53
DPP4 P27487 3/20 0.50
SLC6A2 P23975 4/20 0.45
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41

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
SCHEMBL4807847 0.93 SLC6A3 (0.58) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL29552558 0.93 SLC6A3 (0.63) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL4780476 0.93 SLC6A3 (0.63) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL4742182 0.91 SLC6A3 (0.66) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL13344069 0.88 SLC6A4 (0.46) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL2225745 0.88 PRKACA (0.52) MAOAMAOBTAAR1SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL3493099 0.87 SLC6A4 (0.45) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL27167132 0.84 SLC6A4 (0.41) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL21200393 0.82 ALDH1A1 (0.39) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL29575175 0.82 ALDH1A1 (0.39) MAOAMAOBTAAR1SLC6A4SLC6A3

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-2008063114-A9 AMINO- IMIDAZOLONES AND THEIR USE AS MEDICAMENT FOR TREATING COGNITIVE IMPAIRMENT ALZHEIMER DISEASE, NEURODEGENERATION AND DEMENTIA ASTRAZENECA AB (SE) 2008-09-04 WO disclosed