SCHEMBL6251627

SCHEMBL6251627

CCCc1nn(-c2cccc(OC)c2)c2ncnc(NN)c12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 12/20 0.66
▸ MAPT P10636 3/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ XBP1 P17861 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TP53 P04637 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 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

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
SCHEMBL6207166 0.92 GSK3B (0.66) GSK3BMAPTMEN1KMT2AKDM4E
SCHEMBL8339887 0.84 GSK3B (0.62) GSK3BMAPTMEN1KMT2AKDM4E
SCHEMBL6227233 0.83 GSK3B (0.59) GSK3BMAPTMEN1KMT2AKDM4E
SCHEMBL8344634 0.81 GSK3B (0.66) GSK3BMAPTMEN1KMT2AKDM4E
SCHEMBL8344435 0.80 GSK3B (1.00) GSK3B
SCHEMBL8339313 0.79 GSK3B (0.82) GSK3B
SCHEMBL6205168 0.77 GSK3B (0.61) GSK3BMAPTMEN1KMT2AHSD17B10
SCHEMBL8344653 0.77 GSK3B (0.78) GSK3B
SCHEMBL6203816 0.74 MAPT (0.68) GSK3BMAPTMEN1KMT2AKDM4E
SCHEMBL8342620 0.72 GSK3B (0.82) GSK3B

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
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
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