SCHEMBL1704697

SCHEMBL1704697

CC(=O)N1CCN(c2cc(-c3cccc(Nc4cnccn4)n3)ccn2)CC1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 19/20 0.71
ITK Q08881 1/20 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
SCHEMBL902071 0.91 KARS1 (0.72) KARS1
SCHEMBL1704340 0.87 KARS1 (0.64) KARS1
SCHEMBL1704214 0.87 KARS1 (0.77) KARS1
SCHEMBL902600 0.83 KARS1 (1.00) KARS1
SCHEMBL902003 0.80 KARS1 (0.61) KARS1
SCHEMBL901757 0.80 KARS1 (0.66) KARS1
SCHEMBL1704662 0.80 KARS1 (0.72) KARS1
SCHEMBL1704272 0.79 KARS1 (0.74) KARS1
SCHEMBL1704905 0.79 KARS1 (0.83) KARS1
SCHEMBL901876 0.78 KARS1 (0.71) 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 3 patents. 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 claimed
EP-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed
EP-2441755-A1 Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors Almirall, S.A. (ES) 2012-04-18 EP disclosed