SCHEMBL902808

SCHEMBL902808

Fc1cc(-c2nc(Nc3cnccn3)cc3ccccc23)ccn1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.43
MAPT P10636 8/20 0.41
MAP4K4 O95819 1/20 0.38
MINK1 Q8N4C8 1/20 0.38
TNIK Q9UKE5 1/20 0.38
KARS1 Q15046 2/20 0.38
KDR P35968 1/20 0.37
ADORA2B P29275 2/20 0.37
NQO2 P16083 1/20 0.37
ADORA2A P29274 1/20 0.37
PDE10A Q9Y233 1/20 0.36
NFATC1 O95644 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL901708 0.79 KARS1 (0.66) KARS1DYRK1A
SCHEMBL901846 0.79 KARS1 (0.46) KARS1ADORA2APDE10A
SCHEMBL902716 0.79 KARS1 (0.46) KARS1ADORA2APDE10A
SCHEMBL901301 0.79 KARS1 (0.46) KARS1ADORA2APDE10A
SCHEMBL901245 0.77 KARS1 (0.52) KARS1
SCHEMBL902695 0.76 KARS1 (0.60) SYKMAPTMAP4K4MINK1TNIK
SCHEMBL901702 0.76 KARS1 (0.51) KARS1DYRK1A
SCHEMBL901860 0.76 KARS1 (0.46) KARS1
SCHEMBL902032 0.75 KARS1 (0.52) KARS1
SCHEMBL901736 0.74 KARS1 (0.51) 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 2 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 disclosed
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed