SCHEMBL5709387

SCHEMBL5709387

OCC[C@]1(c2ccc(Cl)cc2)CCc2ccc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.42
SLC6A2 P23975 4/20 0.36
SLC6A4 P31645 4/20 0.36
SLC6A3 Q01959 4/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A9 P48067 1/20 0.34
HSD11B1 P28845 2/20 0.33
CCR1 P32246 1/20 0.33
DRD2 P14416 1/20 0.33
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL5709521 1.00 KDM1A (0.42) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709421 0.86 KDM1A (0.43) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709333 0.86 KDM1A (0.43) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709388 0.84 BCHE (0.42) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709328 0.84 KDM1A (0.37) KDM1ASLC6A2HTR2AHTR2CCCR1
SCHEMBL5709415 0.83 KCNK2 (0.41) KDM1ASLC6A9HSD11B1
SCHEMBL5709358 0.81 KDM1A (0.39) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709491 0.81 KDM1A (0.39) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709389 0.81 KDM1A (0.39) KDM1ASLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL5709361 0.79 HSD11B1 (0.43) KDM1ASLC6A2SLC6A4SLC6A3SLC6A9

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