SCHEMBL14744226

SCHEMBL14744226

CCCNC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3n[nH]c4ccc(CC=O)cc34)nc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.34
LRRK2 Q5S007 3/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 4/20 0.31
FLT3 P36888 1/20 0.31
WNT1 P04628 1/20 0.30
CLK2 P49760 1/20 0.30
CLK3 P49761 1/20 0.30
DYRK1A Q13627 1/20 0.30
DGAT1 O75907 1/20 0.30
PIM1 P11309 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
SCHEMBL14744385 0.86 MAPT (0.33) SYKMAPTMAPK1DGAT1
SCHEMBL14738846 0.79 DGAT1 (0.32) MAPTMAPK1DGAT1
SCHEMBL14737439 0.79 MAPK1 (0.32) SYKMAPTMAPK1DGAT1
SCHEMBL14744496 0.79 DGAT1 (0.32) DGAT1
SCHEMBL14747034 0.79 PDE4A (0.37) MAPTMAPK1
SCHEMBL14738453 0.79 SYK (0.48) SYKMAPTDGAT1
SCHEMBL14737264 0.77 SYK (0.62) SYKLRRK2DYRK1ADGAT1
SCHEMBL14737725 0.77 SYK (0.37) SYKMAPTDGAT1
SCHEMBL14744517 0.77 SYK (0.42) SYKMAPTMAPK1DYRK1ADGAT1
SCHEMBL14752058 0.76 MAP2K4 (0.38) LRRK2MAPK1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853219-B2 Compounds and compositions for cognition-enhancement, methods of making, and methods of treating NEUROSOLIS, INC. (US) 2014-10-07 US disclosed
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed