SCHEMBL2564873

SCHEMBL2564873

Cc1n[nH]c(C)c1OB(Oc1c(C)n[nH]c1C)Oc1c(C)n[nH]c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.44
▸ ENPP3 O14638 1/20 0.41
▸ ALPL P05186 1/20 0.41
▸ ENPP1 P22413 1/20 0.41
▸ XIAP P98170 1/20 0.41
▸ PDE4D Q08499 1/20 0.35
▸ CHEK1 O14757 1/20 0.33
▸ AKT2 P31751 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7691926 0.98 DYRK1A (0.42) DYRK1AENPP3ALPLENPP1XIAP
SCHEMBL7516716 0.82 DYRK1A (0.41) DYRK1AENPP3ALPLENPP1XIAP
Hydrochloric Acid SCHEMBL5612525 0.77 DYRK1A (0.37) DYRK1AENPP3ALPLENPP1XIAP
SCHEMBL14074135 0.75 — —
SCHEMBL6934229 0.65 DYRK1A (0.42) DYRK1A
SCHEMBL31656673 0.64 DYRK1A (0.37) DYRK1AENPP3ALPLENPP1XIAP
SCHEMBL18096491 0.63 HSD17B10 (0.46) ENPP3ALPLENPP1XIAPCHEK1
SCHEMBL17561029 0.62 AKT2 (0.58) DYRK1AALPLPDE4DCHEK1AKT2
SCHEMBL5873234 0.62 DYRK1A (0.50) DYRK1APDE4DCHEK1AKT2MEN1
SCHEMBL22703490 0.61 IKBKE (0.50) ENPP3ALPLENPP1XIAPCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227174-B Functionalized rubbers 戴纳索尔埃拉斯托默罗斯有限公司 2024-04-26 — — CN claimed
US-20170107413-A1 Anti-icing composition driven by catalytic hydrogen generation under subzero temperatures WANG LIANG (US) 2017-04-20 — — US claimed
WO-2005026218-A1 METALLORADICALS AS CHAIN TRANSFER CATALYSTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2005-03-24 — — WO claimed
CN-115433242-B Novel ferromagnetically coupled cyano-bridged iron complex and preparation method thereof 常州大学 2025-02-14 — — CN disclosed
CN-113227174-B Functionalized rubbers 戴纳索尔埃拉斯托默罗斯有限公司 2024-04-26 — — CN disclosed
US-20170107413-A1 Anti-icing composition driven by catalytic hydrogen generation under subzero temperatures WANG LIANG (US) 2017-04-20 — — US disclosed
WO-2011133390-A1 SELECTIVE ACTIVATION AND FUNCTIONALIZATION OF TERMINAL ALKYL CARBON-HYDROGEN BONDS UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-10-27 — — WO disclosed
CN-101429257-A Modified particle and its manufacturing method, carrier, catalyst component for addition polymerization, catalyst for addition polymerization and manufacturing method of addition polymer SUMITOMO CHEMICAL CO (JP) 2009-05-13 — — CN disclosed
CN-1693314-A Modified particle, method for producing catalyst component or catalyst for addition polymerization, and method for producing addition polymer SUMITOMO CHEMICAL CO (JP) 2005-11-09 — — CN disclosed
WO-2005026218-A1 METALLORADICALS AS CHAIN TRANSFER CATALYSTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2005-03-24 — — WO disclosed
Send feedback