SCHEMBL19495291

SCHEMBL19495291

C=C(Cc1cccc2nccnc12)Nc1[nH]cc(C)c1-c1ncn[nH]1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 20/20 0.57
MAPK10 P53779 16/20 0.57
MAPK8 P45983 14/20 0.57
MAPK1 P28482 1/20 0.37

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
SCHEMBL19495352 0.77 MAPK9 (0.69) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3783200 0.72 MAPK9 (1.00) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3776306 0.61 MAPK9 (1.00) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3713718 0.58 KDM4E (0.50) MAPK9MAPK10MAPK8
SCHEMBL6902980 0.57 MAPK8 (0.45) MAPK9MAPK10MAPK8
SCHEMBL29456254 0.57 MAPK8 (0.45) MAPK9MAPK10MAPK8
SCHEMBL8596016 0.57 MAPT (0.48) MAPK9MAPK10MAPK8
SCHEMBL3820241 0.57 MAPT (0.48) MAPK9MAPK10MAPK8
SCHEMBL5545797 0.56 MAPT (0.48) MAPK9MAPK10MAPK8
SCHEMBL435004 0.55 MAPT (0.54) MAPK1

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-2393806-B1 INHIBITORS OF JUN N-TERMINAL KINASE ELAN PHARM INC (US) 2017-10-25 EP disclosed