SCHEMBL1704964

SCHEMBL1704964

CC(C)(C)OC(=O)N1CCN(c2cc(-c3cc(NC(=O)Cc4cccnc4)cc(Nc4cnccn4)n3)ccn2)CC1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 13/20 0.74
WNT3A P56704 2/20 0.50
ACHE P22303 1/20 0.43
GPR119 Q8TDV5 1/20 0.41
TBK1 Q9UHD2 1/20 0.41
SYK P43405 2/20 0.41

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
SCHEMBL1704400 0.92 KARS1 (0.63) KARS1WNT3ASYK
SCHEMBL1705021 0.90 KARS1 (0.61) KARS1WNT3AACHEGPR119TBK1
SCHEMBL1704940 0.90 KARS1 (0.60) KARS1WNT3AGPR119TBK1
SCHEMBL1704770 0.90 KARS1 (0.59) KARS1WNT3AACHEGPR119TBK1
SCHEMBL901834 0.89 KARS1 (0.82) KARS1WNT3ASYK
SCHEMBL1705215 0.88 KARS1 (0.62) KARS1WNT3AGPR119TBK1SYK
SCHEMBL901989 0.88 KARS1 (0.56) KARS1WNT3AACHEGPR119TBK1
SCHEMBL1705312 0.88 KARS1 (0.73) KARS1GPR119TBK1SYK
SCHEMBL1704577 0.87 KARS1 (0.56) KARS1WNT3AACHEGPR119TBK1
SCHEMBL902779 0.87 KARS1 (0.55) KARS1WNT3AGPR119TBK1SYK

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
EP-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed