SCHEMBL902672

SCHEMBL902672

Cc1ccnc(Nc2cccc(-c3ccncc3)n2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 12/20 0.74
SYK P43405 2/20 0.54
MEN1 O00255 3/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
KMT2A Q03164 3/20 0.52
CASP3 P42574 2/20 0.52
SENP8 Q96LD8 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP6 Q9GZR1 2/20 0.52
KCNN1 Q92952 1/20 0.49
KCNN2 Q9H2S1 1/20 0.49
KCNN3 Q9UGI6 1/20 0.49
MAP4K4 O95819 1/20 0.49
ABL1 P00519 1/20 0.49
LCK P06239 1/20 0.49
FYN P06241 1/20 0.49
IGF1R P08069 1/20 0.49
LTK P29376 1/20 0.49
KDR P35968 1/20 0.49

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 0.86 KARS1 (0.79) KARS1SYKMEN1NPC1RAB9A
SCHEMBL902707 0.85 SYK (0.76) KARS1SYKMEN1NPC1RAB9A
SCHEMBL902728 0.82 KARS1 (1.00) KARS1SYKMEN1NPC1RAB9A
SCHEMBL4903188 0.81 KARS1 (0.64) KARS1SYKMEN1NPC1RAB9A
SCHEMBL4902836 0.80 KARS1 (0.62) KARS1SYKMEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL4904575 0.80 KARS1 (0.62) KARS1SYKMEN1NPC1RAB9A
SCHEMBL10268092 0.80 KARS1 (1.00) KARS1SYKMEN1NPC1RAB9A
SCHEMBL901241 0.80 KARS1 (1.00) KARS1SYKMEN1NPC1RAB9A
SCHEMBL13136558 0.80 KARS1 (0.58) KARS1SYKMEN1NPC1RAB9A
SCHEMBL902909 0.80 KARS1 (0.63) KARS1SYKABL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

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