SCHEMBL7469928

SCHEMBL7469928

Fc1cccc(Nc2nccc(-c3ccccn3)n2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.64
BCR P11274 1/20 0.64
PRKCA P17252 1/20 0.64
CDK2 P24941 2/20 0.59
CDK4 P11802 1/20 0.59
SYK P43405 12/20 0.58
CYP1A1 P04798 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP1B1 Q16678 1/20 0.55
PIK3CA P42336 1/20 0.52
PIK3CG P48736 1/20 0.52
DAPK3 O43293 1/20 0.51
JAK2 O60674 1/20 0.51
PRKD3 O94806 1/20 0.51
PIM1 P11309 1/20 0.51
PRKACA P17612 1/20 0.51
FLT3 P36888 1/20 0.51
MAPK8 P45983 1/20 0.51
CSNK1A1 P48729 1/20 0.51
CDK8 P49336 1/20 0.51

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
SCHEMBL7464407 0.84 SYK (0.59) ABL1BCRPRKCACDK2CDK4
SCHEMBL27115765 0.84 CDK2 (0.57) ABL1BCRPRKCACDK2CDK4
SCHEMBL7470857 0.84 ABL1 (0.63) ABL1BCRPRKCACDK2CDK4
SCHEMBL7471678 0.83 ABL1 (0.64) ABL1BCRPRKCACDK2SYK
SCHEMBL5734023 0.83 ABL1 (0.64) ABL1BCRPRKCACDK2CDK4
SCHEMBL4903508 0.83 ABL1 (0.67) ABL1BCRPRKCACDK2CDK4
SCHEMBL5732656 0.83 AURKA (0.66) ABL1BCRPRKCACDK2CDK4
SCHEMBL27115897 0.81 PIK3CG (0.69) CDK2CDK4SYKPIK3CAPIK3CG
SCHEMBL7468539 0.81 ABL1 (0.71) ABL1BCRPRKCACDK2CDK4
SCHEMBL4905854 0.80 ABL1 (0.57) ABL1BCRPRKCASYKPIK3CA

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
EP-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP disclosed