SCHEMBL27654530

SCHEMBL27654530

CCn1nc(-c2cccc(CN)c2)c(C(=O)OC)c(N)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.44
PDE4B Q07343 5/20 0.39
PDE4A P27815 4/20 0.39
PDE4C Q08493 4/20 0.39
PDE4D Q08499 4/20 0.39
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38

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
SCHEMBL28759635 0.88 RIPK2 (0.43) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL27674485 0.88 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL4060209 0.87 HSD17B10 (0.46) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL4059500 0.86 JAK2 (0.43) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL4051848 0.85 TP53 (0.52) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL1652258 0.81 PDE4B (0.48) LOXL2PDE4BPDE4APDE4CPDE4D
SCHEMBL4051093 0.79 LMNA (0.51) PDE4BTP53LMNASMN1; SMN2GABRP
SCHEMBL4050910 0.78 PDE4A (0.49) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL27674487 0.78 LOXL2 (0.48) LOXL2LMNAFGFR1CDK8CDK5
SCHEMBL27654535 0.77 PDE4A (0.39) PDE4BPDE4APDE4CPDE4DSMN1; 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
CN-1878759-A Pyridazin-3 (2H) -one derivatives and their use as PDE4 inhibitors ALMIRALL PRODESFARMA SA (ES) 2006-12-13 CN disclosed