SCHEMBL5709343

SCHEMBL5709343

OCCC1(c2ccc(OCc3ccccc3)cc2)CCc2cc(Cl)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.46
SIGMAR1 Q99720 2/20 0.41
MAOB P27338 5/20 0.40
HTR6 P50406 1/20 0.39
MAOA P21397 3/20 0.39
LTA4H P09960 1/20 0.39
EPHX2 P34913 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTGS2 P35354 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL5709371 0.90 KDM1A (0.47) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709474 0.89 AR (0.40) KDM1AMAOBMEN1NPC1RAB9A
SCHEMBL5709377 0.89 FFAR1 (0.44) KDM1ASIGMAR1MAOBMAOAMRGPRX4
SCHEMBL5709340 0.87 KDM1A (0.43) KDM1ASIGMAR1MAOBMAOAHRH3
SCHEMBL5709462 0.86 KDM1A (0.45) KDM1ASIGMAR1MAOBMAOAMEN1
SCHEMBL5709381 0.82 KCNA5 (0.44) KDM1AMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL27660688 0.77 KDM1A (0.47) KDM1ASIGMAR1MAOBMAOASMN1; SMN2
SCHEMBL5709412 0.75 KDM1A (0.38) KDM1AMAOBMAOALTA4HHIF1A
SCHEMBL5709411 0.75 LTA4H (0.38) KDM1ALTA4HMEN1NPC1RAB9A
SCHEMBL27660872 0.75 KDM1A (0.37) KDM1AMAOBMAOAHIF1AAR

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