SCHEMBL6231350

SCHEMBL6231350

CCOC(OCC)C(CC(=O)O)c1ccc(OC)c(OCC2CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.48
FFAR1 O14842 1/20 0.47
PDE4A P27815 4/20 0.47
PDE4C Q08493 4/20 0.47
PDE4D Q08499 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL497761 0.86 SMN1; SMN2 (0.52) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6227557 0.83 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6229093 0.83 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6228902 0.83 PDE4A (0.49) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6228583 0.83 PDE4A (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL6230314 0.82 PDE4A (0.48) PDE4BFFAR1PDE4APDE4CPDE4D
SCHEMBL6227492 0.82 PDE4A (0.46) PDE4BFFAR1PDE4APDE4CPDE4D
SCHEMBL6232542 0.81 PDE4A (0.53) PDE4BFFAR1PDE4APDE4CPDE4D
SCHEMBL6231663 0.80 PDE4B (0.50) PDE4BPDE4APDE4CPDE4D
SCHEMBL6229294 0.80 PDE4A (0.51) PDE4BPDE4APDE4CPDE4DSMN1; SMN2

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
EP-0933366-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2005-04-06 EP disclosed
US-6235739-B1 ANTIINFLAMMATORY AGENTS; ANTIHISTAMINES; SKIN DISORDERS NIKKEN CHEMICALS CO., LTD. (JP) 2001-05-22 US disclosed
EP-0933366-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-08-04 EP disclosed