SCHEMBL2729451

SCHEMBL2729451

CC(C)C[C@@H](Nc1nc(Nc2cccc(-c3cccnc3)c2)c(C(N)=O)c(=O)[nH]1)C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.65
FLT3 P36888 1/20 0.41
NTSR1 P30989 1/20 0.40

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
SCHEMBL2729456 1.00 SYK (0.65) SYKFLT3NTSR1
SCHEMBL2731671 0.91 SYK (0.53) SYK
SCHEMBL10272190 0.91 SYK (0.63) SYK
SCHEMBL2731677 0.91 SYK (0.53) SYK
SCHEMBL10271724 0.88 SYK (0.52) SYK
SCHEMBL2728643 0.86 SYK (0.48) SYK
SCHEMBL2728647 0.86 SYK (0.48) SYK
SCHEMBL10271911 0.85 SYK (0.54) SYK
SCHEMBL10272086 0.85 SYK (0.49) SYK
SCHEMBL2716671 0.83 SYK (0.51) SYK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed