SCHEMBL31661992

SCHEMBL31661992

Cc1ncn2cc(C(N)=O)cc(Oc3ccc(OCCOC4CCOC4)cc3)c12

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 11/20 0.34
PDE4A P27815 6/20 0.34
PDE4B Q07343 6/20 0.34
PDE4C Q08493 6/20 0.34
ATF4 P18848 1/20 0.33
FPR2 P25090 2/20 0.33
SCN9A Q15858 2/20 0.33
GCK P35557 4/20 0.32
CSF1R P07333 1/20 0.32
PDGFRA P16234 1/20 0.32
STING1 Q86WV6 1/20 0.32
KCNH2 Q12809 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
SCHEMBL31661893 0.80 SCN9A (0.38) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL31662085 0.80 SCN9A (0.38) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL17899129 0.78 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL31661916 0.78 ICAM1 (0.34) PDE4D
SCHEMBL17888576 0.78 PDE4D (0.40) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL17888571 0.78 PDE4D (0.40) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL17888568 0.78 PDE4D (0.40) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL31661983 0.78 CNR2 (0.32) CSF1RPDGFRA
SCHEMBL17888652 0.76 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CATF4
SCHEMBL17888650 0.76 PDE4D (0.42) PDE4DPDE4APDE4BPDE4CATF4

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
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO claimed
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed