SCHEMBL21473790

SCHEMBL21473790

COc1c(NC(=O)c2cc(-n3cnc(C4CC4)c3)c(C)cc2F)cccc1-c1nnnn1C

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAP3K5 Q99683 20/20 0.66

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
SCHEMBL21469856 0.93 MAP3K5 (0.66) MAP3K5
SCHEMBL21469775 0.90 MAP3K5 (0.66) MAP3K5
SCHEMBL21473791 0.85 MAP3K5 (0.64) MAP3K5
SCHEMBL21473910 0.82 MAP3K5 (0.46) MAP3K5
SCHEMBL21473916 0.81 MAP3K5 (0.64) MAP3K5
SCHEMBL21461160 0.80 MAP3K5 (1.00) MAP3K5
SCHEMBL21461106 0.80 MAP3K5 (1.00) MAP3K5
SCHEMBL31249032 0.80 MAP3K5 (1.00) MAP3K5
SCHEMBL21461105 0.79 MAP3K5 (1.00) MAP3K5
SCHEMBL21461100 0.79 MAP3K5 (1.00) MAP3K5

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
WO-2019200267-A1 TRICYCLIC ASK1 INHIBITORS Terns, Inc. (US) 2019-10-17 — — WO disclosed
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