SCHEMBL27667239

SCHEMBL27667239

CC(=O)Oc1c[nH]c2ncc(-c3ccc(CN4CCN(C)CC4)cc3)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K11 Q16584 8/20 0.65
MAP4K1 Q92918 1/20 0.64
TNIK Q9UKE5 13/20 0.63
IKBKB O14920 2/20 0.59
CHUK O15111 2/20 0.59
ABL1 P00519 2/20 0.59
INSR P06213 2/20 0.59
CDK2 P24941 2/20 0.59
FLT3 P36888 2/20 0.59
SGK1 O00141 1/20 0.58
AURKA O14965 1/20 0.58
PRKAB2 O43741 1/20 0.58
ROCK2 O75116 1/20 0.58
NTRK1 P04629 1/20 0.58
LCK P06239 1/20 0.58
CDK1 P06493 1/20 0.58
IGF1R P08069 1/20 0.58
MET P08581 1/20 0.58
CYP3A4 P08684 1/20 0.58
SRC P12931 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
SCHEMBL22971589 0.83 MAP3K11 (0.84) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL4121233 0.83 MAP3K11 (0.67) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL7513626 0.80 TNIK (0.75) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL12067549 0.80 TNIK (0.78) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL722116 0.79 MAP3K11 (1.00) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL723895 0.79 MAP3K11 (1.00) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL12065828 0.79 TNIK (0.79) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL12065847 0.79 TNIK (0.83) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL12065823 0.79 TNIK (0.79) MAP3K11MAP4K1TNIKIKBKBCHUK
SCHEMBL22971621 0.79 MAP3K11 (0.74) MAP3K11MAP4K1TNIKIKBKBCHUK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1972943-A New derivatives of 5-aryl-1h-pyrrolo [2, 3b] pyridine-3-carboxamide or 5-aryl-1h-pyrrolo [2, 3b] pyridine-3-carboxylic acid ASTRAZENECA AB (SE) 2007-05-30 CN disclosed