SCHEMBL902707

SCHEMBL902707

Cc1ccnc(Nc2cccc(-c3ccnc(F)c3)n2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.76
KARS1 Q15046 12/20 0.69
MEN1 O00255 3/20 0.48
NPC1 O15118 3/20 0.48
KMT2A Q03164 3/20 0.48
CASP3 P42574 2/20 0.48
RAB9A P51151 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
KCNN1 Q92952 1/20 0.46
KCNN2 Q9H2S1 1/20 0.46
KCNN3 Q9UGI6 1/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
IGF1R P08069 1/20 0.46

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
SCHEMBL1755624 0.85 KARS1 (0.79) SYKKARS1MEN1NPC1KMT2A
SCHEMBL902672 0.85 KARS1 (0.74) SYKKARS1MEN1NPC1KMT2A
SCHEMBL1704457 0.82 ITK (0.55) SYKKARS1IGF1RKDR
SCHEMBL902728 0.82 KARS1 (1.00) SYKKARS1MEN1NPC1KMT2A
SCHEMBL902695 0.82 KARS1 (0.60) SYKKARS1MAP4K4
SCHEMBL10268092 0.79 KARS1 (1.00) SYKKARS1MEN1NPC1KMT2A
SCHEMBL901241 0.79 KARS1 (1.00) SYKKARS1MEN1NPC1KMT2A
SCHEMBL901240 0.79 KARS1 (0.68) SYKKARS1MAP4K4ABL1LCK
SCHEMBL902781 0.79 KARS1 (1.00) SYKKARS1MEN1NPC1KMT2A
SCHEMBL4903188 0.78 KARS1 (0.64) SYKKARS1MEN1NPC1KMT2A

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 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
WO-2012041476-A1 PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS ALMIRALL, S.A. (ES) 2012-04-05 WO disclosed