SCHEMBL7071964

SCHEMBL7071964

Cc1ccccc1CC(N)COc1cncc(-c2ccc3[nH]nc(C)c3c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 19/20 0.65
AKT3 Q9Y243 4/20 0.60
PRKACA P17612 4/20 0.60
AKT2 P31751 3/20 0.60
DAPK3 O43293 3/20 0.60
RPS6KA5 O75582 3/20 0.60
PRKD3 O94806 3/20 0.60
MAP4K4 O95819 3/20 0.60
PAK4 O96013 3/20 0.60
CHEK2 O96017 3/20 0.60
PRKCG P05129 3/20 0.60
PIM1 P11309 3/20 0.60
PHKG2 P15735 3/20 0.60
CDK2 P24941 3/20 0.60
MAPK1 P28482 3/20 0.60
FLT3 P36888 3/20 0.60
CSNK1A1 P48729 3/20 0.60
CSNK1D P48730 3/20 0.60
MAPKAPK2 P49137 3/20 0.60
GSK3A P49840 3/20 0.60

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
SCHEMBL6849681 1.00 AKT1 (0.65) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6853332 0.93 AKT1 (0.60) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6855551 0.91 AKT1 (0.68) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6857943 0.91 AKT1 (0.77) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6857773 0.90 AKT1 (0.77) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6855237 0.90 AKT1 (0.65) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6854820 0.90 AKT1 (0.77) AKT1AKT3PRKACAAKT2PIM1
SCHEMBL6855175 0.90 AKT1 (0.65) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6853324 0.90 AKT1 (0.64) AKT1AKT3PRKACAAKT2DAPK3
SCHEMBL6854493 0.90 AKT1 (0.65) AKT1AKT3PRKACAAKT2DAPK3

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
EP-1463505-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Abbott Laboratories (US) 2004-10-06 EP claimed
WO-2003051366-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER ABBOTT LABORATORIES (US) 2003-06-26 WO claimed