SCHEMBL901889

SCHEMBL901889

CC(=O)Nc1cc(Nc2cnccn2)nc(-c2ccnc(N3CCNCC3)c2)c1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 17/20 0.81
PRKD1 Q15139 3/20 0.48
PRKD2 Q9BZL6 3/20 0.48
PRKD3 O94806 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
SCHEMBL1755684 0.92 KARS1 (0.78) KARS1PRKD1PRKD2
SCHEMBL1704120 0.90 KARS1 (1.00) KARS1PRKD1PRKD2
SCHEMBL901763 0.89 KARS1 (1.00) KARS1PRKD1PRKD2
SCHEMBL1704268 0.89 KARS1 (1.00) KARS1PRKD1PRKD2PRKD3
SCHEMBL1755643 0.89 KARS1 (1.00) KARS1PRKD1PRKD2
SCHEMBL901757 0.88 KARS1 (0.66) KARS1
SCHEMBL901620 0.88 KARS1 (1.00) KARS1PRKD1PRKD2PRKD3
SCHEMBL1755644 0.88 KARS1 (0.76) KARS1PRKD1PRKD2PRKD3
SCHEMBL901742 0.88 KARS1 (1.00) KARS1PRKD1PRKD2
SCHEMBL902773 0.88 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 4 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
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed