SCHEMBL1704345

SCHEMBL1704345

CC(C)(C)c1ccnc(Nc2cccc(-c3ccnc(NCCNC(=O)O)c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 14/20 0.59
SYK P43405 5/20 0.46

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
SCHEMBL901724 0.90 KARS1 (0.57) KARS1SYK
SCHEMBL901307 0.88 KARS1 (0.77) KARS1SYK
SCHEMBL1704727 0.86 KARS1 (0.54) KARS1SYK
SCHEMBL902605 0.85 KARS1 (0.56) KARS1SYK
SCHEMBL1755661 0.85 KARS1 (0.74) KARS1SYK
SCHEMBL901754 0.83 KARS1 (0.58) KARS1
SCHEMBL12469502 0.82 KARS1 (0.74) KARS1SYK
SCHEMBL1704255 0.79 KARS1 (0.52) KARS1SYK
SCHEMBL901741 0.78 KARS1 (0.74) KARS1SYK
SCHEMBL901406 0.78 KARS1 (0.50) KARS1

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