SCHEMBL15569802

SCHEMBL15569802

CC(C)(C)NC(=O)c1cn(COCC[Si](C)(C)C)c2nccnc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.35
MAPT P10636 2/20 0.33
CNR2 P34972 6/20 0.32
CNR1 P21554 3/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
SYK P43405 1/20 0.31
KLKB1 P03952 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL28132633 0.85 PDE4A (0.36) DGAT1MAPTCNR2CNR1
SCHEMBL28006120 0.85 DGAT1 (0.39) DGAT1MAPTLMNATHRBSYK
SCHEMBL15570073 0.84 DGAT1 (0.37) DGAT1MAPTLMNATHRBSYK
SCHEMBL13858243 0.84 DGAT1 (0.40) DGAT1MAPTLMNATHRBSYK
SCHEMBL28133563 0.83 KLKB1 (0.37) DGAT1MAPTKLKB1NPC1
SCHEMBL28813695 0.81 DGAT1 (0.34) DGAT1
SCHEMBL15569796 0.80 DGAT1 (0.36) DGAT1MAPTLMNATHRBSMN1; SMN2
SCHEMBL15569034 0.79 DGAT1 (0.40) DGAT1MAPTCNR1
SCHEMBL16968270 0.79 SYK (0.52) DGAT1SYK
SCHEMBL16968276 0.79 SYK (0.52) DGAT1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104024258-B Pyrrolopyrazine kinase inhibitors 霍夫曼-拉罗奇有限公司 2017-02-15 CN disclosed
EP-2888262-A1 PYRROLO[2,3-B]PYRAZINES AS SYK INHIBITORS F. Hoffmann-La Roche AG (CH) 2015-07-01 EP disclosed
CN-104507945-A Pyrrolo[2,3-B]pyrazines as SYK inhibitors HOFFMANN LA ROCHE 2015-04-08 CN disclosed
WO-2014029732-A1 PYRROLO[2,3-B]PYRAZINES AS SYK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-02-27 WO disclosed