SCHEMBL23720980

SCHEMBL23720980

CCCc1ccc(-c2cc(C)nc(C(=O)Nc3cccc(-c4nncn4C4CC4)n3)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 19/20 0.48
TNF P01375 1/20 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
SCHEMBL944762 0.87 MAP3K5 (0.51) MAP3K5TNF
SCHEMBL12943387 0.79 MAP3K5 (0.45) MAP3K5
SCHEMBL945769 0.78 MAP3K5 (0.53) MAP3K5TNF
SCHEMBL945392 0.77 MAP3K5 (0.58) MAP3K5TNF
SCHEMBL14553732 0.77 MAP3K5 (0.50) MAP3K5TNF
SCHEMBL944055 0.77 MAP3K5 (0.54) MAP3K5TNF
SCHEMBL944987 0.76 MYLK (0.54) MAP3K5TNF
SCHEMBL945248 0.75 MAP3K5 (0.52) MAP3K5TNF
SCHEMBL945153 0.75 MAP3K5 (0.54) MAP3K5
SCHEMBL946641 0.75 MAP3K5 (0.59) MAP3K5TNF

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-3858824-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS Gilead Sciences, Inc. (US) 2021-08-04 EP disclosed