SCHEMBL5765670

SCHEMBL5765670

CN(C)CCCOc1ccc2c(c1)ncn2-c1ccc2cccc(N3CCC(N(C)C)CC3)c2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 5/20 0.58
IRAK4 Q9NWZ3 2/20 0.58
CDK1 P06493 2/20 0.58
CDK9 P50750 2/20 0.58
CDK3 Q00526 2/20 0.58
CDK5 Q00535 2/20 0.58
MAP4K4 O95819 2/20 0.58
GAK O14976 1/20 0.58
RIPK2 O43353 1/20 0.58
ULK1 O75385 1/20 0.58
STK10 O94804 1/20 0.58
PRKD3 O94806 1/20 0.58
LATS1 O95835 1/20 0.58
PAK4 O96013 1/20 0.58
NTRK1 P04629 1/20 0.58
LCK P06239 1/20 0.58
APRT P07741 1/20 0.58
RET P07949 1/20 0.58
PDGFRB P09619 1/20 0.58
PHKG2 P15735 1/20 0.58

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
SCHEMBL5766748 0.92 CDK2 (0.69) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5764819 0.91 IRAK4 (0.59) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5765790 0.90 IRAK4 (0.62) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5766664 0.88 IRAK4 (0.60) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5766122 0.88 IRAK4 (0.59) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5765455 0.87 CDK2 (0.70) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5765929 0.87 CDK2 (0.59) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5766838 0.85 FGFR1 (0.53) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5764776 0.83 IRAK4 (0.58) CDK2IRAK4CDK1CDK9CDK3
SCHEMBL5765276 0.82 CDK2 (0.56) CDK2IRAK4CDK1CDK9CDK3

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