SCHEMBL6931708

SCHEMBL6931708

NC(COc1cncc(-c2ccc3c(=O)[nH]ccc3c2)c1)Cc1c[nH]c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 19/20 1.00
PRKACA P17612 4/20 0.72
PRKACG P22612 4/20 0.72
PRKACB P22694 4/20 0.72
CDK1 P06493 3/20 0.72
SRC P12931 3/20 0.72
AKT2 P31751 3/20 0.72
AKT3 Q9Y243 3/20 0.72
PRKCG P05129 2/20 0.72
CSNK2A2 P19784 2/20 0.72
MAPK1 P28482 2/20 0.72
CSNK2B P67870 2/20 0.72
CSNK2A1 P68400 2/20 0.72
PRKCE Q02156 2/20 0.72
PIM1 P11309 2/20 0.72
GSK3A P49840 2/20 0.72
GSK3B P49841 2/20 0.72
RPS6KA3 P51812 2/20 0.72
DYRK1A Q13627 2/20 0.72
PRKCD Q05655 2/20 0.72

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
SCHEMBL6854567 1.00 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6854560 1.00 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6855526 0.89 AKT1 (0.82) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6853331 0.87 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6856065 0.86 AKT1 (0.76) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6855488 0.84 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6854467 0.84 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6854499 0.83 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6855461 0.83 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1
SCHEMBL6855412 0.82 AKT1 (1.00) AKT1PRKACAPRKACGPRKACBCDK1

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 disclosed
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 disclosed