SCHEMBL4584803

SCHEMBL4584803

Nc1nccc(-c2[nH]c(CCCN3CCOCC3)nc2-c2ccc(F)cc2)n1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.62
MAPK13 O15264 16/20 0.62
MAPK12 P53778 16/20 0.62
MAPK11 Q15759 16/20 0.62

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
SCHEMBL4584832 0.87 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584431 0.86 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584585 0.85 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4586000 0.85 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584122 0.83 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4585385 0.82 ALOX5 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584037 0.81 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4585395 0.79 ALOX5 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4584913 0.79 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4915298 0.77 MAPK14 (1.00) 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 10 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-2004024083-A2 METHODS OF BONE HEALING UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2004-03-25 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