SCHEMBL28754192

SCHEMBL28754192

CC(=O)Oc1ccc2c(c1)c(-c1cc3c(Cl)ccnc3[nH]1)cn2C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.53
GSK3B P49841 5/20 0.53
CDK7 P50613 5/20 0.53
AURKB Q96GD4 5/20 0.53
LCK P06239 4/20 0.53
GSK3A P49840 4/20 0.53
LRRK2 Q5S007 4/20 0.53
JAK2 O60674 4/20 0.53
BTK Q06187 1/20 0.53
CDK9 P50750 6/20 0.45
PIM1 P11309 4/20 0.45
AURKA O14965 4/20 0.45
ABL1 P00519 4/20 0.45
RET P07949 4/20 0.45
FLT3 P36888 4/20 0.45
CDK5 Q00535 4/20 0.45
PRKAA1 Q13131 4/20 0.45
PAK4 O96013 3/20 0.45
NTRK1 P04629 3/20 0.45
FYN P06241 3/20 0.45

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
SCHEMBL1779401 0.86 IGF1R (0.71) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL12605974 0.83 IGF1R (0.49) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1779619 0.82 SYK (0.50) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1777230 0.77 IGF1R (0.66) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1748886 0.77 IGF1R (0.67) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL12606255 0.76 IGF1R (0.71) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1777163 0.76 SYK (0.73) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1779419 0.75 GSK3B (0.76) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL12606309 0.74 IGF1R (0.62) IGF1RGSK3BCDK7AURKBLCK
SCHEMBL1778874 0.72 IGF1R (0.56) IGF1RGSK3BCDK7AURKBLCK

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
CN-100509811-C Azaindoles AVENTIS PHARMA LTD (GB) 2009-07-08 CN disclosed
CN-1665809-A Azaindoles AVENTIS PHARMA LTD (GB) 2005-09-07 CN disclosed