SCHEMBL21557727

SCHEMBL21557727

Cc1cc(F)cc(Cn2ccc(-c3cn(S)c4ncc(N5CCOCC5)cc34)cc2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 18/20 0.49
▸ STAT6 P42226 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
SCHEMBL21557725 0.91 MAPK1 (0.52) MAPK1STAT6
SCHEMBL25853296 0.91 MAPK1 (0.49) MAPK1
SCHEMBL21557921 0.91 MAPK1 (0.49) MAPK1STAT6
SCHEMBL21557654 0.91 MAPK1 (0.53) MAPK1
SCHEMBL21558021 0.91 MAPK1 (0.53) MAPK1
SCHEMBL21557927 0.89 MAPK1 (0.56) MAPK1
SCHEMBL25852947 0.89 MAPK1 (0.54) MAPK1
SCHEMBL21557661 0.87 MAPK1 (0.52) MAPK1
SCHEMBL21557937 0.87 MAPK1 (0.46) MAPK1STAT6
SCHEMBL21557686 0.86 MAPK1 (0.45) MAPK1STAT6

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-3377491-B1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2019-11-13 — — EP disclosed
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