SCHEMBL29648006

SCHEMBL29648006

C=C(C(N)=O)c1ccc2c(Cl)ncnc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
MAP4K4 O95819 1/20 0.35
SLC22A12 Q96S37 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CSNK2A2 P19784 2/20 0.33
CSNK2B P67870 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
EGFR P00533 1/20 0.33
HIPK2 Q9H2X6 1/20 0.33
SUV39H1 O43463 3/20 0.32
PRMT1 Q99873 3/20 0.32
SMYD3 Q9H7B4 2/20 0.32
FGFR1 P11362 1/20 0.32

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
SCHEMBL6332114 0.80 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DMAP4K4
SCHEMBL4968804 0.80 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DCSNK2A1
SCHEMBL6843232 0.78 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DSLC22A12
Hydrochloric Acid SCHEMBL6332115 0.78 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DCSNK2A1
SCHEMBL694117 0.75 CSNK2A1 (0.57) PDE4APDE4BPDE4CPDE4DCSNK2A1
SCHEMBL29648005 0.72 EGFR (0.50) CSNK2A1CSNK2A2CSNK2BEGFR
SCHEMBL6323082 0.71 HPGD (0.52) POLBSMYD3MEN1MAPTMAPK1
SCHEMBL6331446 0.71 PLA2G7 (0.43) PDE4APDE4BPDE4CPDE4DSLC22A12
SCHEMBL6332625 0.71 HPGD (0.52) MEN1MAPTKMT2A
SCHEMBL4150819 0.71 HPGD (0.56) POLBSMN1; SMN2

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
EP-3999498-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES Kinnate Biopharma Inc. (US) 2022-05-25 EP disclosed