SCHEMBL7128961

SCHEMBL7128961

CC(=O)Nc1cccc(-c2cncc(OCC(N)Cc3c[nH]c4ccccc34)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 1.00
GSK3A P49840 2/20 0.64
RPS6KA3 P51812 2/20 0.64
PRKCD Q05655 2/20 0.64
DYRK1A Q13627 2/20 0.64
PRKD2 Q9BZL6 2/20 0.64
PIM2 Q9P1W9 2/20 0.64
AKT3 Q9Y243 2/20 0.64
EEF2K O00418 1/20 0.64
DYRK3 O43781 1/20 0.64
PRKD3 O94806 1/20 0.64
CSNK1D P48730 1/20 0.64
CLK2 P49760 1/20 0.64
STK3 Q13188 1/20 0.64
CAMK2B Q13554 1/20 0.64
CAMK2G Q13555 1/20 0.64
ERBB4 Q15303 1/20 0.64
CLK4 Q9HAZ1 1/20 0.64
ROCK2 O75116 1/20 0.64
PIM1 P11309 1/20 0.64

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
SCHEMBL6857813 1.00 AKT1 (1.00) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL6857809 1.00 AKT1 (1.00) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL6853380 0.92 AKT1 (1.00) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL6853377 0.92 AKT1 (1.00) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL4660971 0.90 AKT1 (0.81) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL4660981 0.90 AKT1 (0.81) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL4659553 0.85 AKT1 (0.85) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL4659556 0.85 AKT1 (0.85) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL6849748 0.85 AKT1 (1.00) AKT1GSK3ARPS6KA3PRKCDDYRK1A
SCHEMBL6855256 0.84 AKT1 (0.73) AKT1GSK3ARPS6KA3PRKCDDYRK1A

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