SCHEMBL1704545

SCHEMBL1704545

CC(C)(C)[C@]12C[C@@H](CN1C(=O)O)N(c1cc(-c3cc(N)cc(Nc4cc(C(F)(F)F)ccn4)n3)ccn1)C2

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.48

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
SCHEMBL1704085 0.81 SYK (0.49) SYK
SCHEMBL902168 0.77 SYK (0.49) SYK
SCHEMBL1704543 0.77 SYK (0.49) SYK
SCHEMBL901783 0.77 KARS1 (0.56) SYK
SCHEMBL901796 0.70 KARS1 (0.45) SYK
SCHEMBL1704569 0.69 SYK (0.46) SYK
SCHEMBL1704571 0.69 SYK (0.46) SYK
SCHEMBL16875986 0.68 SYK (0.59) SYK
SCHEMBL15990843 0.68 SYK (0.76) SYK
SCHEMBL12469310 0.67 KARS1 (0.56) SYK

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