SCHEMBL6508555

SCHEMBL6508555

CCn1ncc2c(nc(-c3ccc(Cl)cc3Cl)n2-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.47
CNR2 P34972 6/20 0.47
KCNH2 Q12809 2/20 0.43
OPRL1 P41146 1/20 0.41
CRHR1 P34998 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
MCHR1 Q99705 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
SCHEMBL6509465 0.81 GABRA2 (0.44) CNR1CNR2
SCHEMBL1689143 0.69 CNR1 (0.47) CNR1CNR2KCNH2OPRL1KDM4E
SCHEMBL11610988 0.68 TDP1 (0.47) CYP3A4CYP2C19
SCHEMBL4788342 0.67 CRHR1 (0.46) CNR1CNR2CRHR1KDM4EALDH1A1
SCHEMBL4563433 0.67 KMT2A (0.50) CNR1CNR2KCNH2OPRL1
SCHEMBL1689384 0.67 GRM1 (0.47) CNR1CNR2KCNH2KDM4E
SCHEMBL1753298 0.67 F2RL3 (0.46) CNR1CNR2KCNH2
SCHEMBL1753186 0.66 KMT2A (0.46) CNR1CNR2KCNH2
SCHEMBL1753407 0.66 CNR1 (0.44) CNR1CNR2KCNH2
SCHEMBL1688949 0.65 CNR1 (0.48) CNR1CNR2KCNH2OPRL1KDM4E

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