Sugi Predict

Sugi Predict / Compounds / SCHEMBL1704214

SCHEMBL1704214

SCHEMBL1704214

CN1CCN(c2cc(-c3cccc(Nc4cnccn4)n3)ccn2)CC1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KARS1 Q15046 17/20 0.77
▸ MTOR P42345 1/20 0.52
▸ SMG1 Q96Q15 1/20 0.52
▸ DYRK1A Q13627 1/20 0.47

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
SCHEMBL902600 0.87 KARS1 (1.00) KARS1
SCHEMBL1704697 0.87 KARS1 (0.71) KARS1
SCHEMBL902071 0.86 KARS1 (0.72) KARS1
SCHEMBL1704340 0.82 KARS1 (0.64) KARS1
SCHEMBL23901371 0.76 MTOR (0.52) KARS1MTORSMG1
SCHEMBL1755668 0.76 KARS1 (0.60) KARS1
SCHEMBL902695 0.76 KARS1 (0.60) KARS1
SCHEMBL902067 0.76 MTOR (0.54) KARS1MTORSMG1
SCHEMBL902190 0.75 KARS1 (0.58) KARS1
SCHEMBL901824 0.74 KARS1 (1.00) 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