SCHEMBL901245

SCHEMBL901245

OC1CCN(c2cc(-c3nc(Nc4cnccn4)cc4ccccc34)ccn2)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 15/20 0.52
CHEK1 O14757 1/20 0.42
CHEK2 O96017 1/20 0.42
PRKD1 Q15139 1/20 0.41
PIM1 P11309 2/20 0.40
ITGB2 P05107 1/20 0.38
ICAM1 P05362 1/20 0.38
ITGAL P20701 1/20 0.38

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
SCHEMBL901860 0.94 KARS1 (0.46) KARS1CHEK1CHEK2PRKD1ITGB2
SCHEMBL901846 0.90 KARS1 (0.46) KARS1CHEK1CHEK2
SCHEMBL901708 0.87 KARS1 (0.66) KARS1PRKD1
SCHEMBL901702 0.85 KARS1 (0.51) KARS1
SCHEMBL901301 0.82 KARS1 (0.46) KARS1PRKD1
SCHEMBL902716 0.82 KARS1 (0.46) KARS1PRKD1
SCHEMBL902032 0.81 KARS1 (0.52) KARS1PRKD1PIM1
SCHEMBL901704 0.80 CKS1B (0.48) KARS1
SCHEMBL1704427 0.78 KARS1 (0.44) KARS1
SCHEMBL901688 0.78 KARS1 (0.48) 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 5 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
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO 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
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed