SCHEMBL5337466

SCHEMBL5337466

Oc1ncc2[nH]ncc2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 3/20 0.39
▸ HSP90AA1 P07900 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ NOS1 P29475 5/20 0.35
▸ FGFR1 P11362 3/20 0.35
▸ FGFR2 P21802 2/20 0.35
▸ FGFR3 P22607 1/20 0.35
▸ CHEK1 O14757 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ METAP2 P50579 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HIF1A Q16665 2/20 0.31
▸ PKM P14618 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CSNK2A1 P68400 1/20 0.31

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
SCHEMBL3118472 0.74 DYRK1A (0.39) DYRK1AHSP90AA1IDO1CDK2NOS1
SCHEMBL23530790 0.74 ALDH1A1 (0.44) DYRK1AHSP90AA1IDO1CDK2NOS1
SCHEMBL3117779 0.74 DYRK1A (0.39) DYRK1AHSP90AA1IDO1CDK2NOS1
SCHEMBL3120925 0.71 DYRK1A (0.34) DYRK1AHSP90AA1IDO1CDK2MKNK1
SCHEMBL3120521 0.69 DYRK1A (0.36) DYRK1AHSP90AA1IDO1CDK2CHEK1
SCHEMBL3105087 0.69 DYRK1A (0.36) DYRK1AHSP90AA1IDO1CDK2CHEK1
SCHEMBL2331764 0.69 DYRK1A (0.36) DYRK1AHSP90AA1IDO1CDK2CHEK1
SCHEMBL31382890 0.69 METAP2 (0.41) DYRK1AHSP90AA1IDO1CDK2CHEK1
SCHEMBL22941856 0.69 DYRK1A (0.36) DYRK1AHSP90AA1IDO1CDK2CHEK1
SCHEMBL6886742 0.68 XDH (0.34) DYRK1AHSP90AA1IDO1CDK2NOS1

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-0378483-B1 Use of 4-mercapto-6-hydroxy-pyrazolo-(4,3-d)-pyrimidine as a scavenger of free radicals BOUCHARA SA (FR) 1996-08-14 — — EP claimed
WO-2007069924-A1 DEAZAPURINE ANALOGS OF 4'-AZA-L-NUCLEOSIDES INDUSTRIAL RESEARCH LIMITED (NZ) 2007-06-21 — — WO disclosed
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