SCHEMBL5765634

SCHEMBL5765634

NC1CCN(c2cccc3ccc(-n4cnc5cc(C(=O)NCCN6CCOCC6)ccc54)nc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 1/20 0.55
MAP4K4 O95819 2/20 0.55
GAK O14976 1/20 0.55
RIPK2 O43353 1/20 0.55
ULK1 O75385 1/20 0.55
STK10 O94804 1/20 0.55
PRKD3 O94806 1/20 0.55
LATS1 O95835 1/20 0.55
PAK4 O96013 1/20 0.55
NTRK1 P04629 1/20 0.55
LCK P06239 1/20 0.55
CDK1 P06493 1/20 0.55
APRT P07741 1/20 0.55
RET P07949 1/20 0.55
PDGFRB P09619 1/20 0.55
PHKG2 P15735 1/20 0.55
NQO2 P16083 1/20 0.55
PDGFRA P16234 1/20 0.55
FECH P22830 1/20 0.55

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
SCHEMBL5766844 0.87 ALDH1A1 (0.49) ALDH1A1MAPK1MAP4K4GAKRIPK2
SCHEMBL5766585 0.82 GAK (0.60) ALDH1A1MAP4K4GAKRIPK2ULK1
SCHEMBL4679785 0.81 CDK2 (0.69) MAP4K4GAKRIPK2ULK1STK10
Hydrochloric Acid SCHEMBL5764183 0.80 CDK2 (0.68) MAPK1MAP4K4GAKRIPK2ULK1
SCHEMBL5762999 0.78 PRKD3 (0.60) ALDH1A1MAP4K4GAKRIPK2ULK1
SCHEMBL6023741 0.77 CDK2 (0.57) ALDH1A1MAP4K4GAKRIPK2ULK1
SCHEMBL3189583 0.76 IRAK4 (0.63) MAP4K4GAKRIPK2ULK1STK10
SCHEMBL5765925 0.76 LCK (0.58) ALDH1A1MAP4K4GAKRIPK2ULK1
SCHEMBL3836322 0.75 IRAK4 (0.69) MAP4K4GAKRIPK2ULK1STK10
SCHEMBL5766588 0.74 IRAK4 (0.66) MAP4K4GAKRIPK2ULK1STK10

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