SCHEMBL5709371

SCHEMBL5709371

Clc1ccc2c(c1)CCC2(CCBr)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.47
SIGMAR1 Q99720 2/20 0.42
MAOB P27338 7/20 0.40
MAOA P21397 5/20 0.40
HRH3 Q9Y5N1 1/20 0.39
AR P10275 3/20 0.38
RORC P51449 1/20 0.38
BCHE P06276 1/20 0.37

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
SCHEMBL5709343 0.90 KDM1A (0.46) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709377 0.88 FFAR1 (0.44) KDM1ASIGMAR1MAOBMAOA
SCHEMBL5709340 0.88 KDM1A (0.43) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709462 0.85 KDM1A (0.45) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709383 0.82 KCNA5 (0.44) KDM1ASIGMAR1ARBCHE
SCHEMBL5709474 0.81 AR (0.40) KDM1AMAOBHRH3AR
SCHEMBL27660688 0.78 KDM1A (0.47) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709412 0.74 KDM1A (0.38) KDM1AMAOBMAOA
SCHEMBL5709411 0.74 LTA4H (0.38) KDM1AAR
SCHEMBL27660872 0.74 KDM1A (0.37) KDM1AMAOBMAOAAR

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
CN-1950328-A Phenyl indan derivatives LUNDBECK & CO AS H (DK) 2007-04-18 CN disclosed
EP-1727785-A1 PHENYL INDAN DERIVATIVES H.Lundbeck A/S (DK) 2006-12-06 EP disclosed
WO-2005087708-A1 PHENYL INDAN DERIVATIVES H. LUNDBECK A/S (DK) 2005-09-22 WO disclosed