SCHEMBL5487608

SCHEMBL5487608

[CH2]CC(CCCc1ccc(Cl)cc1)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.46
SLC6A2 P23975 2/20 0.46
HRH1 P35367 2/20 0.46
CHRM2 P08172 1/20 0.46
ADRA2C P18825 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNH2 Q12809 1/20 0.46
CACNA1C Q13936 1/20 0.46
SCN5A Q14524 1/20 0.46
SIGMAR1 Q99720 2/20 0.45
CHRM4 P08173 1/20 0.45
HTR2C P28335 1/20 0.45
HTR7 P34969 1/20 0.45
TMEM97 Q5BJF2 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CHRM1 P11229 2/20 0.41
HTR2A P28223 2/20 0.41
MCHR1 Q99705 2/20 0.41

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
SCHEMBL6570349 0.85 MC4R (0.49) HRH3SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL6570194 0.83 MC4R (0.50) HRH3SLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL491563 0.83 HRH3 (0.57) HRH3SLC6A2HRH1CHRM2ADRA2C
SCHEMBL6569758 0.75 HRH3 (0.45) HRH3SLC6A2HRH1CHRM2ADRA2C
SCHEMBL28676989 0.73 HRH3 (0.43) HRH3SLC6A2HRH1CHRM2ADRA2C
SCHEMBL10420233 0.70 HRH3 (0.46) HRH3SLC6A2HRH1CHRM2ADRA2C
SCHEMBL28751840 0.69 TP53 (0.50) HRH3SLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL12847346 0.69 ALDH1A1 (0.49) HRH3SLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL4935993 0.69 HRH1 (0.49) HRH3SLC6A2HRH1SLC6A4SLC6A3
SCHEMBL491565 0.69 HRH3 (0.60) HRH3SLC6A2HRH1CHRM2ADRA2C

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
EP-1100503-B1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H 3?-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS ILE BIOPROJET SOC CIV (FR) 2004-09-22 EP claimed
EP-1863487-A2 TREATMENT OF PARKINSON'S DISEASE, OBSTRUCTIVE SLEEP APNEA, DEMENTIA WITH LEWY BODIES, VASCULAR DEMENTIA WITH NON-IMIDAZOLE ALKYLAMINES HISTAMINE H3-RECEPTOR LIGANDS BIOPROJET (FR) 2007-12-12 EP disclosed
WO-2006103546-A2 TREATMENT OF PARKINSON'S DISEASE, OBSTRUCTIVE SLEEP APNEA, DEMENTIA WITH LEWY BODIES, VASCULAR DEMENTIA WITH NON-IMIDAZOLE ALKYLAMINES HISTAMINE H3-RECEPTOR LIGANDS BIOPROJET (FR) 2006-10-05 WO disclosed