SCHEMBL5763268

SCHEMBL5763268

FC(F)(F)c1ccc(-c2[nH]cc(C3=CC4CC(c5ccccc5)CN4CC3)c2-c2ccncc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 5/20 0.55
MAPK14 Q16539 5/20 0.55
MAPK13 O15264 2/20 0.35
RAF1 P04049 2/20 0.35
MAPK12 P53778 2/20 0.35
KIF11 P52732 1/20 0.32
F2R P25116 2/20 0.30
MAPK9 P45984 1/20 0.30

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
SCHEMBL6220074 0.92 MAPK11 (0.56) MAPK11MAPK14RAF1
SCHEMBL6220174 0.91 MAPK14 (0.48) MAPK11MAPK14MAPK13RAF1MAPK12
SCHEMBL5764109 0.91 MAPK14 (0.48) MAPK11MAPK14MAPK13RAF1MAPK12
SCHEMBL5764416 0.91 MAPK14 (0.67) MAPK11MAPK14
SCHEMBL5763394 0.91 MAPK14 (0.67) MAPK11MAPK14
SCHEMBL6218157 0.91 MAPK14 (0.67) MAPK11MAPK14
SCHEMBL5764180 0.89 MAPK14 (0.55) MAPK11MAPK14MAPK13RAF1MAPK12
SCHEMBL5763263 0.89 MAPK11 (0.48) MAPK11MAPK14
SCHEMBL6222012 0.88 MAPK14 (0.65) MAPK11MAPK14MAPK13MAPK12
SCHEMBL6219480 0.87 MAPK11 (0.54) MAPK11MAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1377577-B1 PYRROLE DERIVATES FOR TREATING CYTOKINE MEDIATED DISEASES SANKYO CO (JP) 2006-06-14 EP claimed