SCHEMBL4584963

SCHEMBL4584963

CN1CCC(c2nc(-c3ccc(F)cc3)c(-c3ccnc(NCCCN4CCOCC4)n3)[nH]2)CC1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.54
MAPK13 O15264 6/20 0.54
MAPK12 P53778 6/20 0.54
MAPK11 Q15759 6/20 0.54
CDK4 P11802 1/20 0.46
GSK3B P49841 1/20 0.46
MKNK1 Q9BUB5 1/20 0.45

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
SCHEMBL5766657 0.88 MAPK13 (0.54) MAPK14MAPK13MAPK12MAPK11CDK4
SCHEMBL5772849 0.87 MAPK13 (0.60) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5771702 0.86 MAPK13 (0.52) MAPK14MAPK13MAPK12MAPK11CDK4
SCHEMBL5773466 0.86 MAPK13 (0.59) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4587310 0.85 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6075375 0.85 MAPK13 (0.76) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5771519 0.85 MAPK13 (0.52) MAPK14MAPK13MAPK12MAPK11CDK4
SCHEMBL5768594 0.84 MAPK13 (0.59) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5772504 0.84 MAPK13 (0.57) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5767879 0.83 MAPK13 (0.71) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539121-A4 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC (US) 2008-08-13 EP disclosed
EP-1545535-A4 TREATMENT OF PAIN BY INHIBITION OF P38 MAP KINASE SCIOS INC (US) 2008-06-04 EP disclosed
EP-1583535-A4 METHODS FOR TREATING DIABETES SCIOS INC (US) 2008-03-19 EP disclosed
EP-1583535-A2 METHODS FOR TREATING DIABETES SCIOS INC. (US) 2005-10-12 EP disclosed
EP-1545535-A2 TREATMENT OF PAIN BY INHIBITION OF P38 MAP KINASE SCIOS INC. (US) 2005-06-29 EP disclosed
EP-1539121-A2 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC. (US) 2005-06-15 EP disclosed
WO-2004053107-A2 METHODS FOR TREATING DIABETES SCIOS INC. (US) 2004-06-24 WO disclosed
WO-2004021988-A2 TREATMENT OF PAIN BY INHIBITION OF P38 MAP KINASE SCIOS INC. (US) 2004-03-18 WO disclosed
WO-2004019873-A2 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC. (US) 2004-03-11 WO disclosed