SCHEMBL6231659

SCHEMBL6231659

CCOC(OCC)C(CC(=O)O)c1ccc(OC)c(OC2Cc3ccccc3C2)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.55
PDE4B Q07343 14/20 0.51
PDE4A P27815 11/20 0.51
PDE4C Q08493 9/20 0.51
PDE4D Q08499 9/20 0.51
SMN1; SMN2 Q16637 1/20 0.44
TNF P01375 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
SCHEMBL6228583 0.86 PDE4A (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL497761 0.83 SMN1; SMN2 (0.52) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL4728355 0.82 PDE4B (0.56) FFAR1PDE4BPDE4APDE4CPDE4D
SCHEMBL6231781 0.81 PDE4B (0.48) FFAR1PDE4BPDE4APDE4CPDE4D
SCHEMBL6232542 0.79 PDE4A (0.53) FFAR1PDE4BPDE4APDE4CPDE4D
SCHEMBL6231350 0.78 PDE4B (0.48) FFAR1PDE4BPDE4APDE4CPDE4D
SCHEMBL6229294 0.77 PDE4A (0.51) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6229093 0.76 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6227557 0.76 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DSMN1; SMN2
SCHEMBL6228902 0.76 PDE4A (0.49) 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