Pitolisant

Pitolisant

SCHEMBL5487588

CC(C)(C)CCOCCCN1CCCCC1.Clc1ccc(CCCOCCCN2CCCCC2)cc1.c1ccc(CCCOCCCN2CCCCC2)cc1.c1ccc2sc(OCCCN3CCCCC3)nc2c1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HRH3

The experimentally established mechanism targets of Pitolisant. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 known ✓ Q9Y5N1 8/20 0.54
HRH1 P35367 4/20 0.54
SLC6A4 P31645 3/20 0.54
SLC6A2 P23975 2/20 0.54
KCNH2 Q12809 2/20 0.54
CHRM2 P08172 1/20 0.54
ADRA2C P18825 1/20 0.54
SLC6A3 Q01959 1/20 0.54
CACNA1C Q13936 1/20 0.54
SCN5A Q14524 1/20 0.54
HTR7 P34969 3/20 0.53
HTR2C P28335 2/20 0.53
CHRM4 P08173 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
LTA4H P09960 6/20 0.51
PPARG P37231 2/20 0.48
PPARA Q07869 2/20 0.48
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45

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
SCHEMBL6566705 0.80 HRH3 (0.80) HRH3HRH1SLC6A4SLC6A2KCNH2
SCHEMBL491694 0.78 LTA4H (0.78) HRH3KCNH2LTA4H
Pitolisant SCHEMBL117648 0.74 HRH3 (1.00) HRH3HRH1SLC6A4SLC6A2KCNH2
Pitolisant SCHEMBL4591893 0.72 HRH3 (1.00) HRH3HRH1SLC6A4SLC6A2KCNH2
SCHEMBL28088120 0.72 PPARG (0.65) KCNH2LTA4HPPARGPPARAPTGS1
SCHEMBL6570257 0.72 LTA4H (0.69) HRH3KCNH2LTA4H
SCHEMBL6362230 0.71 LTA4H (0.87) KCNH2LTA4H
SCHEMBL491655 0.71 HRH3 (1.00) HRH3HRH1SLC6A4SLC6A2KCNH2
SCHEMBL492156 0.70 HRH3 (0.97) HRH3HRH1SLC6A4SLC6A2KCNH2
Pitolisant SCHEMBL4592979 0.70 HRH3 (0.85) HRH3HRH1SLC6A4SLC6A2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed