SCHEMBL4608505

SCHEMBL4608505

COc1ccc(CN2CC3CCC(O)(c4ccc(CCN5CCCC5)cc4)C3C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.53
SIGMAR1 Q99720 2/20 0.46
KDM4E B2RXH2 1/20 0.42
MBTD1 Q05BQ5 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGIR P43119 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL4624651 0.88 ALDH1A1 (0.46) HRH3KDM4EGAA
SCHEMBL14538734 0.88 ALDH1A1 (0.46) HRH3KDM4EGAA
SCHEMBL4608914 0.88 SLC6A3 (0.47) HRH3SIGMAR1MBTD1L3MBTL3L3MBTL1
SCHEMBL4607915 0.88 ACHE (0.45) HRH3MBTD1L3MBTL3L3MBTL1SLC6A4
SCHEMBL4608628 0.84 HRH3 (0.42) HRH3SIGMAR1MBTD1L3MBTL3L3MBTL1
SCHEMBL4610283 0.84 KDM4E (0.45) HRH3KDM4EMBTD1L3MBTL3L3MBTL1
SCHEMBL4610133 0.83 HRH3 (0.44) HRH3SIGMAR1MBTD1L3MBTL3L3MBTL1
SCHEMBL4608156 0.83 SLC6A3 (0.46) HRH3SIGMAR1MBTD1L3MBTL3L3MBTL1
SCHEMBL4607800 0.82 HRH3 (0.39) HRH3MBTD1L3MBTL3L3MBTL1
SCHEMBL4609186 0.81 HRH3 (0.52) HRH3SIGMAR1MBTD1L3MBTL3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948605-A2 MODULATORS OF THE H3 RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-07-30 EP claimed
WO-2007061741-A2 MODULATORS OF THE H3 RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-05-31 WO claimed
EP-1948605-A2 MODULATORS OF THE H3 RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-07-30 EP disclosed
WO-2007061741-A2 MODULATORS OF THE H3 RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-05-31 WO disclosed
WO-2007061741-A2 MODULATORS OF THE H3 RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-05-31 WO disclosed