SCHEMBL23720763

SCHEMBL23720763

C/C(=C\N=C(/C)F)c1ccnc(C(=O)NC2=CC(c3nncn3C3CC3)=CCC2)c1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP3K5 Q99683 14/20 0.37
▸ MYLK Q15746 1/20 0.32
▸ AKT1 P31749 4/20 0.31
▸ TNF P01375 1/20 0.31
▸ CBLB Q13191 5/20 0.31

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
SCHEMBL22738980 0.76 MAP3K5 (0.41) MAP3K5AKT1TNF
SCHEMBL23721141 0.73 MAP3K5 (0.45) MAP3K5AKT1CBLB
SCHEMBL22739302 0.72 MAP3K5 (0.56) MAP3K5CBLB
SCHEMBL23721207 0.71 MAP3K5 (0.45) MAP3K5MYLK
SCHEMBL22739288 0.67 CBLB (0.34) CBLB
SCHEMBL22739099 0.64 MAP3K5 (0.43) MAP3K5AKT1
SCHEMBL22739036 0.63 MAP3K5 (0.39) MAP3K5AKT1
SCHEMBL22738977 0.62 MAP3K5 (0.58) MAP3K5CBLB
SCHEMBL22738975 0.61 MAP3K5 (0.42) MAP3K5MYLKAKT1TNFCBLB
SCHEMBL23721029 0.61 MAP3K5 (0.40) MAP3K5MYLKAKT1

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
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