SCHEMBL6202199

SCHEMBL6202199

CCOC(C)Nc1nccc(-c2c(-c3ccc(F)cc3)c(=O)n3n2CCCC3C(=O)OC)n1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 20/20 0.58
MAPK12 P53778 20/20 0.58
MAPK11 Q15759 20/20 0.58
MAPK14 Q16539 20/20 0.58

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
SCHEMBL6202205 0.89 MAPK14 (0.74) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6202228 0.87 MAPK14 (0.70) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6202225 0.87 MAPK14 (0.70) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6202202 0.85 MAPK13 (0.58) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6203111 0.79 MAPK14 (0.73) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6203113 0.79 MAPK14 (0.73) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6202073 0.79 MAPK14 (0.50) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6201603 0.75 MAPK13 (0.49) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6204867 0.75 MAPK13 (0.49) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6204078 0.75 MAPK13 (0.49) MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427727-B1 COMPOUNDS WHICH INHIBIT THE RELEASE OF INFLAMMATORY CYTOKINES PROCTER & GAMBLE (US) 2005-01-26 EP disclosed
US-6821971-B2 FOR PROPHYALXIS OF RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, INFLAMMATORY BOWEL DISEASE (IBS), SEPTIC SHOCK, CARDIOPULMONARY DYSFUNCTION, ACUTE RESPIRATORY DISEASE, CACHEXIA THE PROCTER & GAMBLE COMPANY 2004-11-23 US disclosed
EP-1427727-A1 COMPOUNDS WHICH INHIBIT THE RELEASE OF INFLAMMATORY CYTOKINES THE PROCTER & GAMBLE COMPANY (US) 2004-06-16 EP disclosed
WO-2003024970-A1 COMPOUNDS WHICH INHIBIT THE RELEASE OF INFLAMMATORY CYTOKINES THE PROCTER & GAMBLE COMPANY (US) 2003-03-27 WO disclosed