SCHEMBL15533684

SCHEMBL15533684

COc1ccc(-c2ccnc(Nc3ccc(C(F)(F)F)cn3)n2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
MAPT P10636 6/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 3/20 0.46
MEN1 O00255 3/20 0.46
RAB9A P51151 3/20 0.46
ZAP70 P43403 3/20 0.46
EGFR P00533 2/20 0.46
PRKD3 O94806 2/20 0.46
PRKCG P05129 2/20 0.46
PRKCB P05771 2/20 0.46
LCK P06239 2/20 0.46
PRKCA P17252 2/20 0.46
PRKCH P24723 2/20 0.46
PRKCI P41743 2/20 0.46
PRKCE Q02156 2/20 0.46
PRKCQ Q04759 2/20 0.46
PRKCZ Q05513 2/20 0.46
PRKCD Q05655 2/20 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
SCHEMBL15533545 0.87 DYRK1A (0.49) DYRK1ACLK4MAPTKMT2AGAA
SCHEMBL15533865 0.85 SYK (0.53) DYRK1ACLK4MAPTKMT2AMEN1
SCHEMBL15533951 0.83 PIK3CG (0.50) DYRK1ACLK4MAPTKMT2AGAA
SCHEMBL15534348 0.81 MEN1 (0.46) DYRK1ACLK4MAPTKMT2AGAA
SCHEMBL15534241 0.80 CLK1 (0.63) DYRK1ACLK4MAPTABL1BCR
SCHEMBL15533965 0.80 SYK (0.51) DYRK1ACLK4MAPTKMT2AGAA
SCHEMBL15533631 0.80 ABL1 (0.46) CLK4MAPTKMT2AGAAMEN1
SCHEMBL14742731 0.80 MEN1 (0.73) MAPTKMT2AGAAMEN1RAB9A
SCHEMBL15534009 0.78 MAPT (0.48) DYRK1ACLK4MAPTGAAZAP70
SCHEMBL15533704 0.77 ABL1 (0.47) DYRK1ACLK4MAPTZAP70EGFR

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