SCHEMBL7215207

SCHEMBL7215207

CC1(c2nc(-c3ccc(F)cc3)c(-c3ccnc(OCCCO)n3)[nH]2)OCC(C(N)=O)CO1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.42
MAPK13 O15264 6/20 0.41
MAPK12 P53778 6/20 0.41
MAPK11 Q15759 6/20 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
SCHEMBL7222296 0.82 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7215202 0.82 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6075875 0.79 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5771460 0.78 MAPK14 (0.40) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5771176 0.78 MAPK14 (0.40) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5772045 0.78 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6808788 0.77 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11
SCHEMBL7217798 0.77 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5772812 0.77 MAPK14 (0.39) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5773935 0.76 MAPK13 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6602877-B1 Imidazolyl-cyclic acetals AVENTIS PHARMA LIMITED (GB) 2003-08-05 US disclosed