SCHEMBL25852706

SCHEMBL25852706

Cc1cc(C)cc(Cn2ccc(-c3cn(SI)c4ncc(N5CCOCC5)cc34)cc2=O)c1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 19/20 0.51

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
SCHEMBL25852058 0.93 MAPK1 (0.53) MAPK1
SCHEMBL25856932 0.90 MAPK1 (0.56) MAPK1
SCHEMBL25853244 0.88 MAPK1 (0.51) MAPK1
SCHEMBL25852278 0.86 MAPK1 (0.53) MAPK1
SCHEMBL25833943 0.86 MAPK1 (0.56) MAPK1
SCHEMBL25857373 0.85 MAPK1 (0.53) MAPK1
SCHEMBL25857520 0.84 MAPK1 (0.46) MAPK1
SCHEMBL25971078 0.84 MAPK1 (0.53) MAPK1
SCHEMBL21557654 0.83 MAPK1 (0.53) MAPK1
SCHEMBL21557727 0.83 MAPK1 (0.49) 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
WO-2023135233-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2023-07-20 — — WO disclosed
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