SCHEMBL9099996

SCHEMBL9099996

CONc1ccc(CCN2N=C(c3ccc(OC)c(OC)c3)CCC2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.64
PDE4D Q08499 3/20 0.60
PDE4A P27815 2/20 0.60
PDE4C Q08493 2/20 0.60
PDE3B Q13370 1/20 0.60
PDE3A Q14432 1/20 0.60
LMNA P02545 1/20 0.57

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
SCHEMBL6654240 0.89 PDE4B (0.61) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6654325 0.89 PDE4B (0.61) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6656013 0.89 PDE4B (0.61) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6654148 0.88 PDE4B (0.59) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6654145 0.88 PDE4B (0.59) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6658933 0.88 PDE4B (0.59) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6655380 0.87 PDE4B (0.61) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6678792 0.87 PDE4B (0.58) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6660998 0.87 PDE4B (0.58) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL6656328 0.86 PDE4B (0.68) PDE4BPDE4DPDE4APDE4CPDE3B

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-0738715-A2 Arylalkyl-pyridazinones MERCK PATENT GmbH (DE) 1996-10-23 EP disclosed