SCHEMBL7895152

SCHEMBL7895152

Oc1ccccc1OC1CCNCC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 6/20 0.62
HTR1A P08908 4/20 0.57
SLC6A2 P23975 4/20 0.57
SLC6A3 Q01959 2/20 0.57
HSP90AB1 P08238 2/20 0.43
TOP2A P11388 2/20 0.43
KCNH2 Q12809 1/20 0.43
SCN5A Q14524 1/20 0.43
CHRM3 P20309 1/20 0.43
SLC6A4 P31645 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
SCHEMBL2549977 0.86 CA2 (0.48) HRH1HTR1ASLC6A2SLC6A3CHRM3
SCHEMBL9988552 0.82 CA1 (0.45) HRH1HTR1ASLC6A2SLC6A3CHRM3
SCHEMBL873580 0.82 CA1 (0.45) HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL1833804 0.81 MCHR1 (0.45) HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL1836440 0.81 MCHR1 (0.45) HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL1834837 0.81 MCHR1 (0.45) HRH1SLC6A2SLC6A3SLC6A4
SCHEMBL234010 0.78 SLC6A2 (0.81) HRH1HTR1ASLC6A2SLC6A3CHRM3
SCHEMBL82594 0.78 HRH1 (0.62) HRH1HTR1ASLC6A2SLC6A3SLC6A4
SCHEMBL82955 0.78 HRH1 (0.62) HRH1HTR1ASLC6A2SLC6A3KCNH2
SCHEMBL1229562 0.78 HRH1 (0.62) HRH1HTR1ASLC6A2SLC6A3SLC6A4

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-2010100606-A1 NOVEL PHENYL IMIDAZOLES AND PHENYL TRIAZOLES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2010-09-10 WO disclosed