SCHEMBL6507095

SCHEMBL6507095

O=c1c2nn(-c3ccccc3Cl)c(Cl)c2cnn1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.53
NPBWR1 P48145 1/20 0.44
ALDH1A1 P00352 6/20 0.43
HPGD P15428 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
PKM P14618 3/20 0.42
PKLR P30613 1/20 0.42
NPSR1 Q6W5P4 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
GPR35 Q9HC97 1/20 0.42
MAPT P10636 2/20 0.41
PDE4A P27815 2/20 0.41
PDE4B Q07343 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 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
SCHEMBL6510594 0.85 CNR1 (0.74) CNR1
SCHEMBL6514552 0.77 CNR1 (0.63) CNR1NPSR1LMNA
SCHEMBL5381254 0.72 ALDH1A1 (0.49) CNR1ALDH1A1TDP1SMN1; SMN2PDE4B
SCHEMBL22989951 0.71 MAPT (0.48) NPBWR1ALDH1A1HPGDTDP1PKM
SCHEMBL1691901 0.70 HTT (0.71) NPBWR1ALDH1A1HPGDTDP1PKM
SCHEMBL6506416 0.70 CNR1 (1.00) CNR1
SCHEMBL6511635 0.70 BRD4 (0.44) CNR1NPBWR1ALDH1A1HPGDTDP1
SCHEMBL25341629 0.68 NPBWR1 (0.60) NPBWR1ALDH1A1HPGDTDP1PKM
SCHEMBL31174056 0.68 HTT (0.59) NPBWR1ALDH1A1HPGDTDP1PKM
SCHEMBL4821388 0.68 CNR1 (0.74) CNR1ALDH1A1POLBKDM4E

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
WO-2005061504-A1 BICYCLIC PYRIDAZINONE CANNABINOID RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2005-07-07 WO disclosed
WO-2005061504-A1 BICYCLIC PYRIDAZINONE CANNABINOID RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2005-07-07 WO disclosed