SCHEMBL15533704

SCHEMBL15533704

COc1ccc(-c2ccnc(Nc3ccncc3C(F)(F)F)n2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.47
BCR P11274 5/20 0.47
DYRK1A Q13627 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
PRKCA P17252 2/20 0.47
PRKD3 O94806 1/20 0.47
PRKCG P05129 1/20 0.47
PRKCB P05771 1/20 0.47
LCK P06239 1/20 0.47
PRKCH P24723 1/20 0.47
PRKCI P41743 1/20 0.47
ZAP70 P43403 1/20 0.47
PRKCE Q02156 1/20 0.47
PRKCQ Q04759 1/20 0.47
PRKCZ Q05513 1/20 0.47
PRKCD Q05655 1/20 0.47
PRKD1 Q15139 1/20 0.47
PIK3CG P48736 5/20 0.46
CAMKK2 Q96RR4 4/20 0.46
JAK2 O60674 2/20 0.45

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
SCHEMBL15533961 0.87 CAMKK2 (0.53) DYRK1ACLK4PIK3CGCAMKK2JAK2
SCHEMBL15533699 0.81 CCNB2 (0.43) ABL1BCRDYRK1ACLK4PRKCA
SCHEMBL15533865 0.80 SYK (0.53) ABL1BCRDYRK1ACLK4PRKCA
SCHEMBL15534009 0.80 MAPT (0.48) DYRK1ACLK4PRKCAPRKD3PRKCG
SCHEMBL15535232 0.80 MAPT (0.47) ABL1BCRDYRK1ACLK4PRKCA
SCHEMBL15533263 0.78 CLK1 (0.64) DYRK1ACLK4CDK2ULK1MAPT
SCHEMBL15534241 0.77 CLK1 (0.63) ABL1BCRDYRK1ACLK4PIK3CG
SCHEMBL15533684 0.77 DYRK1A (0.47) ABL1BCRDYRK1ACLK4PRKCA
SCHEMBL15533545 0.77 DYRK1A (0.49) ABL1BCRDYRK1ACLK4ZAP70
SCHEMBL4903233 0.76 JAK2 (0.65) ABL1BCRDYRK1ACLK4PRKCA

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