SCHEMBL4254982

SCHEMBL4254982

Cc1nccn1Cc1ccc(Nc2nc(O)c3cc[nH]c3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.45
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LRRK2 Q5S007 5/20 0.38
PTK2 Q05397 5/20 0.37
CHEK1 O14757 2/20 0.37
AURKA O14965 2/20 0.37
DAPK3 O43293 2/20 0.37
MAP4K4 O95819 2/20 0.37
PAK4 O96013 2/20 0.37
RET P07949 2/20 0.37
LTK P29376 2/20 0.37
KDR P35968 2/20 0.37
MAPK8 P45983 2/20 0.37
MAPK9 P45984 2/20 0.37
CSNK1A1 P48729 2/20 0.37
RPS6KA3 P51812 2/20 0.37
JAK3 P52333 2/20 0.37
CDK5 Q00535 2/20 0.37
MAP2K1 Q02750 2/20 0.37

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
SCHEMBL4251723 0.88 JAK2 (0.46) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL13883576 0.81 JAK2 (0.40) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL4081376 0.80 JAK2 (0.40) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL4255795 0.79 JAK1 (0.38) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL13883496 0.79 JAK2 (0.38) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL13883718 0.78 AXL (0.38) JAK2TNIKJAK1TTK
SCHEMBL13883557 0.78 IKBKB (0.40) JAK2LMNAL3MBTL1PTK2TNIK
SCHEMBL3964284 0.77 JAK2 (0.37) JAK2LMNAL3MBTL1LRRK2PTK2
SCHEMBL4409833 0.76 TNIK (0.37) JAK2LRRK2PTK2CHEK1AURKA
SCHEMBL3973621 0.75 JAK2 (0.38) JAK2LMNAL3MBTL1LRRK2PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009055674-A1 PYRROLOPYRIMIDINE ALKYNYL COMPOUNDS AND METHODS OF MAKING AND USING SAME TARGEGEN INC. (US) 2009-04-30 WO disclosed
WO-2009049028-A1 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USE AS JANUS KINASE MODULATORS TARGEGEN INC. (US) 2009-04-16 WO disclosed
WO-2009049028-A1 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USE AS JANUS KINASE MODULATORS TARGEGEN INC. (US) 2009-04-16 WO disclosed