SCHEMBL901243

SCHEMBL901243

Cc1ccnc(Nc2cccc(-c3cccc(C4=CCNCC4)c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 16/20 0.59
HTR2C P28335 2/20 0.43
SYK P43405 1/20 0.42

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
SCHEMBL902737 0.85 KARS1 (0.63) KARS1HTR2CSYK
SCHEMBL901538 0.84 KARS1 (0.60) KARS1HTR2C
SCHEMBL902609 0.83 HTR2C (0.44) KARS1HTR2C
SCHEMBL1705140 0.81 KDR (0.42) KARS1HTR2CSYK
SCHEMBL901312 0.77 KARS1 (0.54) KARS1SYK
SCHEMBL1704379 0.76 KARS1 (0.62) KARS1HTR2C
SCHEMBL902728 0.75 KARS1 (1.00) KARS1SYK
SCHEMBL901240 0.74 KARS1 (0.68) KARS1SYK
SCHEMBL901824 0.74 KARS1 (1.00) KARS1
SCHEMBL1755624 0.74 KARS1 (0.79) KARS1SYK

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
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