SCHEMBL5762999

SCHEMBL5762999

CCOC(=O)c1ccc2c(c1)ncn2-c1ccc2cccc(N3CCC(N)CC3)c2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 2/20 0.60
MAP4K4 O95819 2/20 0.60
CAMK2D Q13557 2/20 0.60
DYRK1A Q13627 2/20 0.60
MAP4K5 Q9Y4K4 2/20 0.60
GAK O14976 1/20 0.60
RIPK2 O43353 1/20 0.60
ULK1 O75385 1/20 0.60
STK10 O94804 1/20 0.60
LATS1 O95835 1/20 0.60
PAK4 O96013 1/20 0.60
NTRK1 P04629 1/20 0.60
LCK P06239 1/20 0.60
CDK1 P06493 1/20 0.60
APRT P07741 1/20 0.60
RET P07949 1/20 0.60
PDGFRB P09619 1/20 0.60
PHKG2 P15735 1/20 0.60
NQO2 P16083 1/20 0.60
PDGFRA P16234 1/20 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
SCHEMBL5766585 0.87 GAK (0.60) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL5767002 0.86 MAP4K4 (0.46) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL5762977 0.84 IRAK4 (0.76) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL5765925 0.84 LCK (0.58) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL6023741 0.82 CDK2 (0.57) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL3189583 0.81 IRAK4 (0.63) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL5766588 0.81 IRAK4 (0.66) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL3836778 0.81 IRAK4 (0.73) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5
SCHEMBL5767107 0.80 MAPT (0.46) HPGDALDH1A1LMNATP53MAPT
SCHEMBL5763184 0.79 IRAK4 (0.71) PRKD3MAP4K4CAMK2DDYRK1AMAP4K5

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7019147-B1 Benzimidazole derivatives useful as antiproliferative agents PFIZER INC. (US) 2006-03-28 US claimed
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 EP claimed
EP-1235825-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS Pfizer Products Inc. (US) 2002-09-04 EP claimed
WO-2001040217-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PRODUCTS INC. (US) 2001-06-07 WO claimed
US-7019147-B1 Benzimidazole derivatives useful as antiproliferative agents PFIZER INC. (US) 2006-03-28 US disclosed
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 EP disclosed
EP-1235825-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS Pfizer Products Inc. (US) 2002-09-04 EP disclosed
WO-2001040217-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PRODUCTS INC. (US) 2001-06-07 WO disclosed