SCHEMBL1009432

SCHEMBL1009432

CCCN(CC)Cc1ccc(CCl)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.59
PYCR1 P32322 1/20 0.43
MAPT P10636 1/20 0.43

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
Hydrochloric Acid SCHEMBL1470307 0.98 HRH3 (0.57) HRH3PYCR1MAPT
SCHEMBL8252162 0.83 HRH3 (0.63) HRH3PYCR1MAPT
SCHEMBL13778397 0.82 HRH3 (0.61) HRH3PYCR1MAPT
Chloromethane SCHEMBL27279686 0.80 HRH3 (0.53) HRH3
SCHEMBL3180482 0.80 CNR2 (0.56) HRH3
SCHEMBL9286253 0.79 HRH3 (0.57) HRH3
SCHEMBL31260447 0.78 HRH3 (0.57) HRH3PYCR1MAPT
Hydrochloric Acid SCHEMBL11571118 0.78 HRH3 (0.55) HRH3
SCHEMBL22340500 0.77 HRH3 (0.55) HRH3PYCR1
SCHEMBL10990959 0.77 MAPT (0.58) HRH3MAPT

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-2094706-B1 SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS SANOFI AVENTIS (FR) 2011-01-05 EP disclosed
EP-2094706-A2 SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS Sanofi-Aventis (FR) 2009-09-02 EP disclosed
WO-2008068424-A2 SUBSTITUTED 2,5-DIHYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS SANOFI-AVENTIS (FR) 2008-06-12 WO disclosed