SCHEMBL1633334

SCHEMBL1633334

NC(=O)c1cc(Nc2ncc3cc(-c4cnoc4)c(OC4CCNCC4)cc3n2)cc(N2CCOCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.46
MAPK10 P53779 1/20 0.41
JAK2 O60674 8/20 0.38
TBK1 Q9UHD2 7/20 0.38
EPHB4 P54760 1/20 0.38
RIPK2 O43353 2/20 0.36
JAK3 P52333 1/20 0.35
PIK3CA P42336 1/20 0.35

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
SCHEMBL1634531 0.90 SYK (0.47) SYKMAPK10JAK2TBK1EPHB4
SCHEMBL1633301 0.87 MAPK10 (0.53) SYKMAPK10JAK2TBK1RIPK2
SCHEMBL1633459 0.86 SYK (0.46) SYKMAPK10JAK2TBK1EPHB4
SCHEMBL1634528 0.84 SYK (0.47) SYKJAK2TBK1EPHB4JAK3
SCHEMBL1633561 0.82 MAP4K1 (0.42) SYKMAPK10JAK2TBK1EPHB4
SCHEMBL13498346 0.81 SYK (0.43) SYKMAPK10JAK2TBK1EPHB4
SCHEMBL12764830 0.79 SYK (0.46) SYKJAK2TBK1EPHB4JAK3
SCHEMBL13498258 0.79 SYK (0.46) SYKJAK2TBK1EPHB4JAK3
SCHEMBL1633041 0.79 SYK (0.46) SYKJAK2TBK1EPHB4JAK3
SCHEMBL1571608 0.78 SYK (0.47) SYKMAPK10JAK2TBK1EPHB4

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-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed