SCHEMBL3801248

SCHEMBL3801248

NC(=O)Oc1cc(-c2cnc(Nc3ccc(N4CCN(CC(F)(F)F)CC4)cc3)c3ncnn23)cs1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 11/20 0.47
SYK P43405 2/20 0.35
TNIK Q9UKE5 2/20 0.34
STAT6 P42226 1/20 0.34
MAP4K4 O95819 1/20 0.34
WEE1 P30291 1/20 0.34
FGFR1 P11362 1/20 0.34
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
PTK2 Q05397 1/20 0.33

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
SCHEMBL3796304 0.91 MAPKAPK5 (0.38) MAPKAPK5SYKJAK2JAK1
SCHEMBL3802993 0.89 MAPKAPK5 (0.48) MAPKAPK5SYKJAK2JAK1PTK2
SCHEMBL1476975 0.89 MAPKAPK5 (0.58) MAPKAPK5SYKTNIKSTAT6MAP4K4
SCHEMBL3798752 0.88 MAPKAPK5 (0.61) MAPKAPK5SYKMAP4K4
SCHEMBL3801487 0.88 MAPKAPK5 (0.61) MAPKAPK5
SCHEMBL3805490 0.86 MAPKAPK5 (0.53) MAPKAPK5SYKSTAT6PTK2
SCHEMBL3795246 0.85 MAPKAPK5 (0.51) MAPKAPK5SYK
SCHEMBL3803732 0.80 MAPKAPK5 (0.38) MAPKAPK5SYKJAK2JAK1
SCHEMBL1476985 0.80 MAPKAPK5 (0.48) MAPKAPK5SYKJAK2JAK1
SCHEMBL2217998 0.79 MAPKAPK5 (0.74) MAPKAPK5TNIKMAP4K4WEE1FGFR1

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-2029602-B1 TRIAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2010-04-21 EP claimed