SCHEMBL27615973

SCHEMBL27615973

COC(=O)C(CO)Cc1ccc2c(c1)c(-c1cc3nccnc3[nH]1)cn2C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 15/20 0.59
▸ GSK3A P49840 12/20 0.59
▸ IGF1R P08069 5/20 0.59
▸ CDK7 P50613 5/20 0.59
▸ AURKB Q96GD4 5/20 0.59
▸ LCK P06239 4/20 0.59
▸ LRRK2 Q5S007 4/20 0.59
▸ JAK2 O60674 4/20 0.59
▸ BTK Q06187 1/20 0.59
▸ CDK5 Q00535 11/20 0.44
▸ AURKA O14965 4/20 0.44
▸ ABL1 P00519 4/20 0.44
▸ RET P07949 4/20 0.44
▸ FLT3 P36888 4/20 0.44
▸ PRKAA1 Q13131 4/20 0.44
▸ PAK4 O96013 3/20 0.44
▸ NTRK1 P04629 3/20 0.44
▸ FYN P06241 3/20 0.44
▸ CSF1R P07333 3/20 0.44
▸ MET P08581 3/20 0.44

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
SCHEMBL14304581 0.82 GSK3B (0.67) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL12605836 0.80 GSK3B (0.57) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL7641466 0.79 GSK3B (0.56) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL27634796 0.78 GSK3B (0.61) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL3104144 0.78 GSK3B (0.69) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL27615934 0.77 GSK3B (0.66) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL1777186 0.75 GSK3B (0.65) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL27613602 0.75 GSK3B (0.55) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL1778596 0.75 GSK3B (1.00) GSK3BGSK3AIGF1RCDK7AURKB
SCHEMBL27615961 0.75 GSK3B (0.62) GSK3BGSK3AIGF1RCDK7AURKB

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
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