SCHEMBL1009434

SCHEMBL1009434

O=c1cc(O)cc(-c2ccc(Cl)cc2Cl)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 6/20 0.50
NPSR1 Q6W5P4 3/20 0.50
BLM P54132 2/20 0.50
ABCB1 P08183 1/20 0.50
MAPK1 P28482 1/20 0.50
ESR1 P03372 1/20 0.49
ALDH1A1 P00352 8/20 0.42
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
MAPT P10636 6/20 0.42
PKM P14618 1/20 0.42
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 3/20 0.42
HPGD P15428 6/20 0.41
TDP1 Q9NUW8 1/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 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
SCHEMBL1008973 0.81 MEN1 (0.60) POLBNPSR1ALDH1A1NPC1RAB9A
SCHEMBL6961356 0.77 PRKDC (0.53) NPSR1ABCB1MAPK1ESR1ALDH1A1
SCHEMBL6958354 0.72 CA12 (0.55) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8107451 0.69 MAOB (0.49) POLBMAPK1ALDH1A1NPC1RAB9A
SCHEMBL8109864 0.69 ATM (0.54) POLBMAPK1ESR1ALDH1A1MAPT
SCHEMBL1009790 0.68 ABCB1 (0.46) POLBNPSR1BLMABCB1MAPK1
SCHEMBL6000158 0.68 MAPT (0.54) POLBNPSR1BLMABCB1MAPK1
SCHEMBL14800563 0.68 NPC1 (0.66) POLBNPSR1BLMMAPK1ALDH1A1
SCHEMBL2636529 0.68 ALDH1A1 (0.66) POLBNPSR1MAPK1ALDH1A1NPC1
SCHEMBL5193894 0.68 ALDH1A1 (0.60) POLBNPSR1MAPK1ALDH1A1NPC1

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