SCHEMBL10900264

SCHEMBL10900264

CCCCNc1ccc2c(c1)CCC1CC(=O)NN=C21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.49
CRBN Q96SW2 4/20 0.48
KCNH2 Q12809 1/20 0.46
PDE3A Q14432 8/20 0.41
PDE3B Q13370 5/20 0.41
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
GPR119 Q8TDV5 3/20 0.38
AR P10275 1/20 0.36
PDE4B Q07343 2/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL10740298 0.90 PDE3A (0.50) HRH3CRBNKCNH2PDE3APDE3B
SCHEMBL21970124 0.87 HRH3 (0.48) HRH3CRBNKCNH2PDE3APDE3B
SCHEMBL10341508 0.79 PDE3B (0.53) HRH3CRBNKCNH2PDE3APDE3B
SCHEMBL10341540 0.79 HRH3 (0.50) HRH3KCNH2PDE3APDE3BITGB3
SCHEMBL10753732 0.79 HRH3 (0.46) HRH3CRBNKCNH2PDE3APDE3B
Hydrochloric Acid SCHEMBL11092318 0.78 PDE3B (0.49) HRH3CRBNKCNH2PDE3APDE3B
SCHEMBL10341521 0.76 HRH3 (0.62) HRH3KCNH2PDE3APDE3BGPR119
SCHEMBL10753296 0.74 HRH3 (0.54) HRH3KCNH2PDE3APDE3BPDE4B
SCHEMBL8305150 0.74 HRH3 (0.54) HRH3KCNH2PDE3APDE3BGPR119
SCHEMBL9602068 0.74 HRH3 (0.57) HRH3CRBNKCNH2PDE3APDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0169443-A2 Tricyclic dihydropyridazinones and pharmaceutical compositions contaning them BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1986-01-29 EP disclosed