SCHEMBL6205168

SCHEMBL6205168

CCc1nn(-c2cccc(OC)c2)c2ncnc(Cl)c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 10/20 0.61
▸ CCNB2 O95067 1/20 0.45
▸ CCNE2 O96020 1/20 0.45
▸ CDK1 P06493 1/20 0.45
▸ CDK4 P11802 1/20 0.45
▸ CCNB1 P14635 1/20 0.45
▸ CCND1 P24385 1/20 0.45
▸ CCNE1 P24864 1/20 0.45
▸ CDK2 P24941 1/20 0.45
▸ CCNB3 Q8WWL7 1/20 0.45
▸ PIK3CD O00329 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ SRC P12931 1/20 0.42
▸ GPBAR1 Q8TDU6 1/20 0.41
▸ PI4KA P42356 1/20 0.41
▸ PI4K2B Q8TCG2 1/20 0.41
▸ PI4K2A Q9BTU6 1/20 0.41
▸ PI4KB Q9UBF8 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL8339887 0.93 GSK3B (0.62) GSK3BCDK1PIK3CDMAPTSRC
SCHEMBL6207166 0.83 GSK3B (0.66) GSK3BMAPTSRCPI4KAPI4K2B
SCHEMBL8338999 0.81 GSK3B (0.61) GSK3BCDK1PIK3CDMAPTSRC
SCHEMBL6227233 0.80 GSK3B (0.59) GSK3BCDK1MAPTSRCPI4KA
SCHEMBL6251627 0.77 GSK3B (0.66) GSK3BMAPTSRCPI4KAPI4K2B
Ammonia Solution, Strong SCHEMBL28485616 0.73 KDM4E (0.45) GSK3BPIK3CDMAPTTSHRHSD17B10
SCHEMBL839950 0.73 SLC2A1 (0.60) GSK3BMAPTHSD17B10MEN1NPC1
SCHEMBL8344435 0.71 GSK3B (1.00) GSK3B
SCHEMBL22604319 0.71 SRC (0.50) GSK3BCDK1SRCPI4KAPI4K2B
SCHEMBL3403614 0.71 KDM4E (0.55) GSK3BPIK3CDMAPTSRCHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551841-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SmithKline Beecham Corporation (US) 2005-07-13 — — EP disclosed
WO-2004009602-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 — — WO disclosed
WO-2004009602-A1 PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-29 — — WO disclosed
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