SCHEMBL8791980

SCHEMBL8791980

OC(CCN1CCc2cccc(OCc3ccccc3)c21)c1cccc(Br)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
MAOB P27338 1/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
CHRNA7 P36544 2/20 0.38
PTGER4 P35408 1/20 0.37
PTGER2 P43116 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
HTT P42858 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL7135913 0.78 MAOB (0.38) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL8534018 0.78 MAOB (0.38) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7140321 0.78 SLC6A2 (0.45) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7136382 0.78 SLC6A2 (0.45) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7137289 0.78 MAOB (0.38) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7133283 0.75 MAOB (0.39) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7133285 0.75 MAOB (0.39) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL7139327 0.75 MAOB (0.39) MAOBCARM1PRMT5WDR77CHRNA7
SCHEMBL19149405 0.74 HTT (0.43) MAOBCHRNA7PTGER4PTGER2HTT
SCHEMBL19148290 0.74 ADRA1D (0.44) SIGMAR1CHRNA7PTGER4PTGER2ADRA1D

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
EP-0775694-A2 Process for preparing N-benzyl indoles University of East Anglia (GB) 1997-05-28 EP disclosed