SCHEMBL28984083

SCHEMBL28984083

O=C=Cc1c(Cl)ncnc1Cl

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.33
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 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
SCHEMBL275155 0.72 KMT2A (0.40) NFE2L2PDE4APDE4BPDE4CPDE4D
SCHEMBL6066165 0.70 KMT2A (0.39) NFE2L2PDE4APDE4BPDE4CPDE4D
Hydrazine SCHEMBL5282146 0.68 KMT2A (0.37) NFE2L2PDE4APDE4BPDE4CPDE4D
SCHEMBL13754216 0.67 PDE4A (0.34) NFE2L2PDE4APDE4BPDE4CPDE4D
SCHEMBL28865029 0.67 PDE4A (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL29092583 0.67 NPSR1 (0.32)
SCHEMBL30540796 0.66
SCHEMBL29280970 0.65
SCHEMBL6066125 0.64 MEN1 (0.38)
SCHEMBL13946887 0.64 ALDH1A1 (0.34) NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115968369-A Process for the preparation of compounds as PI3K inhibitors and intermediate compounds useful for the preparation thereof 株式会社保宁 2023-04-14 CN disclosed