SCHEMBL10271838

SCHEMBL10271838

COc1nc(N[C@@H](C(N)=O)C(C)C)nc(Nc2ccc3ncccc3c2)c1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.52
AURKA O14965 2/20 0.47
TNIK Q9UKE5 1/20 0.45
BTK Q06187 1/20 0.43
LRRK2 Q5S007 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL2719190 0.89 SYK (0.52) SYKAURKATNIKBTKLRRK2
SCHEMBL10272206 0.88 SYK (0.48) SYKAURKATNIKBTKLRRK2
SCHEMBL10272079 0.86 SYK (0.70) SYKAURKATNIKBTKNPC1
SCHEMBL2716327 0.84 SYK (0.49) SYKAURKATNIKBTKLRRK2
SCHEMBL2717505 0.83 SYK (0.50) SYKAURKATNIKBTKLRRK2
SCHEMBL16743188 0.82 SYK (0.60) SYKTNIKBTKNPC1
SCHEMBL16194907 0.82 SYK (0.75) SYK
SCHEMBL14977146 0.82 SYK (0.75) SYK
SCHEMBL10271839 0.81 SYK (0.49) SYKAURKATNIKNPC1
SCHEMBL10271722 0.80 SYK (0.56) 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 1 patent. 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