SCHEMBL9752783

SCHEMBL9752783

Cc1nnc(NCCCCN2CC3CCC(CC3)C2)c2cc3ccccn3c12

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.49
PDE4D Q08499 14/20 0.49
SOD1 P00441 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9752495 0.97 PDE4B (0.52) PDE4BPDE4DSOD1
SCHEMBL9871473 0.88 PDE4B (0.55) PDE4BPDE4D
SCHEMBL9871070 0.87 PDE4B (0.57) PDE4BPDE4D
SCHEMBL9870196 0.86 PDE4B (0.56) PDE4BPDE4D
SCHEMBL9752566 0.85 PDE4B (0.58) PDE4BPDE4D
SCHEMBL9870693 0.84 PDE4B (0.58) PDE4BPDE4D
SCHEMBL9752995 0.84 PDE4B (0.60) PDE4BPDE4D
SCHEMBL9872416 0.83 PDE4B (0.59) PDE4BPDE4D
SCHEMBL9752624 0.81 PDE4B (0.45) PDE4BPDE4D
SCHEMBL9870800 0.79 PDE4B (0.45) PDE4BPDE4D

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-1991010664-A1 PYRIDAZINO[4,5-b]INDOLIZINES AMERICAN HOME PRODUCTS CORPORATION (US) 1991-07-25 WO claimed
US-4985560-A Pyridazino(4,5-b)indolizines AMERICAN HOME PRODUCTS CORPORATION (US) 1991-01-15 US disclosed