SCHEMBL15533951

SCHEMBL15533951

COc1ccc(-c2ccnc(Nc3ccc(Br)cn3)n2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 7/20 0.50
PIK3CB P42338 5/20 0.50
DYRK1A Q13627 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
MEN1 O00255 3/20 0.48
RAB9A P51151 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
EGFR P00533 2/20 0.48
PRKD3 O94806 2/20 0.48
PRKCG P05129 2/20 0.48
PRKCB P05771 2/20 0.48
LCK P06239 2/20 0.48
PRKCA P17252 2/20 0.48
PRKCH P24723 2/20 0.48
PRKCI P41743 2/20 0.48
ZAP70 P43403 2/20 0.48
PRKCE Q02156 2/20 0.48
PRKCQ Q04759 2/20 0.48

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
SCHEMBL15533684 0.83 DYRK1A (0.47) PIK3CGPIK3CBDYRK1ACLK4MEN1
SCHEMBL15533647 0.80 PIK3CG (0.45) PIK3CGPIK3CBMEN1RAB9AKMT2A
SCHEMBL15533883 0.80 MAPK8 (0.45) PIK3CGMEN1RAB9AKMT2AMAPT
SCHEMBL15533672 0.79 MAPT (0.48) CLK4MEN1RAB9AKMT2AMAPT
SCHEMBL14088787 0.77 JAK2 (0.59) PIK3CGPIK3CBDYRK1ACLK4MEN1
SCHEMBL4903233 0.77 JAK2 (0.65) PIK3CGPIK3CBDYRK1ACLK4MEN1
SCHEMBL15533545 0.76 DYRK1A (0.49) PIK3CGPIK3CBDYRK1ACLK4MEN1
SCHEMBL15533771 0.76 DYRK1A (0.54) PIK3CGPIK3CBDYRK1ACLK4MEN1
SCHEMBL3381635 0.75 FYN (0.50) DYRK1AMEN1RAB9AKMT2AMAPT
SCHEMBL13279659 0.75 MEN1 (0.52) PIK3CGPIK3CBMEN1RAB9AKMT2A

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
WO-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 WO claimed
WO-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 WO disclosed