SCHEMBL7136382

SCHEMBL7136382

OC[C@H](O)[C@H](c1cccc(Br)c1)N1CCc2cccc(OCc3ccccc3)c21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.45
SLC6A4 P31645 8/20 0.45
MAOB P27338 1/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT5 O14744 2/20 0.38
WDR77 Q9BQA1 2/20 0.38
CHRNA7 P36544 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
USP28 Q96RU2 1/20 0.35
USP25 Q9UHP3 1/20 0.35

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
SCHEMBL7140321 1.00 SLC6A2 (0.45) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL4715366 0.92 SLC6A2 (0.44) SLC6A2SLC6A4CARM1PRMT5WDR77
SCHEMBL8534018 0.84 MAOB (0.38) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL7135913 0.84 MAOB (0.38) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL7137289 0.84 MAOB (0.38) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL7133285 0.81 MAOB (0.39) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL7139327 0.81 MAOB (0.39) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL7133283 0.81 MAOB (0.39) SLC6A2SLC6A4MAOBCARM1PRMT5
SCHEMBL4086867 0.78 SLC6A2 (0.57) SLC6A2SLC6A4
SCHEMBL8791980 0.78 SLC18A3 (0.39) MAOBCARM1PRMT5WDR77CHRNA7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6509476-B1 Leukotriene antagonists; antiallergens, antiinflammatory agents, and antiasthmatic agents THE UNIVERSITY OF EAST ANGLIA (GB) 2003-01-21 US disclosed
US-5807866-A Process for preparing N-benzyl indoles THE UNIVERSITY OF EAST ANGLIA (GB) 1998-09-15 US disclosed
EP-0775694-A2 Process for preparing N-benzyl indoles University of East Anglia (GB) 1997-05-28 EP disclosed