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SCHEMBL1704893

SCHEMBL1704893

CC(C)(C)OC(=O)N1CCN(c2cc(-c3cc(NC(=O)c4cccnc4)cc(Nc4cc(C(F)(F)F)ccn4)n3)ccn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KARS1 Q15046 10/20 0.61
▸ SYK P43405 10/20 0.54

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
SCHEMBL1705312 0.91 KARS1 (0.73) KARS1SYK
SCHEMBL901977 0.90 KARS1 (0.65) KARS1SYK
SCHEMBL1704625 0.90 KARS1 (0.61) KARS1SYK
SCHEMBL902653 0.87 KARS1 (0.80) KARS1SYK
SCHEMBL1704251 0.86 KARS1 (0.73) KARS1SYK
SCHEMBL1704600 0.85 KARS1 (0.73) KARS1SYK
SCHEMBL1704267 0.84 KARS1 (0.63) KARS1SYK
SCHEMBL902673 0.84 KARS1 (0.65) KARS1SYK
SCHEMBL901980 0.83 SYK (0.55) KARS1SYK
SCHEMBL1704942 0.83 KARS1 (0.64) KARS1SYK

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