SCHEMBL1704340

SCHEMBL1704340

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

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 18/20 0.64
GPR119 Q8TDV5 1/20 0.48
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 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
SCHEMBL1704341 0.89 KARS1 (0.55) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL902983 0.89 KARS1 (0.64) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL901697 0.89 KARS1 (0.65) KARS1CKS1BSKP1SKP2
SCHEMBL901333 0.88 KARS1 (0.65) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL901508 0.87 KARS1 (0.56) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL902995 0.87 KARS1 (0.67) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL1704453 0.87 KARS1 (0.52) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL1704732 0.87 KARS1 (0.52) KARS1GPR119CKS1BSKP1SKP2
SCHEMBL1704697 0.87 KARS1 (0.71) KARS1
SCHEMBL1704262 0.87 KARS1 (0.51) KARS1GPR119

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