SCHEMBL22475426

SCHEMBL22475426

Cc1cc(Nc2nc(NC3CCCCC3NC(=O)OC(C)(C)C)cc3c2C(=O)NC3)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.53
FER P16591 1/20 0.45
BTK Q06187 2/20 0.40
TYK2 P29597 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL14930598 1.00 SYK (0.53) SYKFERBTKTYK2HDAC4
SCHEMBL29949698 1.00 SYK (0.53) SYKFERBTKTYK2HDAC4
SCHEMBL16751349 0.92 SYK (0.56) SYKFERBTKTYK2
SCHEMBL1990177 0.90 SYK (0.59) SYKFERBTKTYK2
SCHEMBL1990162 0.90 SYK (0.59) SYKFERBTKTYK2
SCHEMBL21032755 0.87 SYK (0.71) SYKFERBTKTYK2
SCHEMBL22475414 0.87 SYK (0.71) SYKFERBTKTYK2
SCHEMBL29949466 0.87 SYK (0.71) SYKFERBTKTYK2
SCHEMBL14930565 0.87 SYK (0.71) SYKFERBTKTYK2
SCHEMBL12605543 0.86 SYK (0.51) SYKFERBTKTYK2

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-3489236-B1 PROCESS FOR THE PREPARATION OF FUSED HETEROAROMATIC PYRROLIDINONES TAKEDA PHARMACEUTICALS CO (JP) 2020-09-30 EP disclosed