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SCHEMBL7490773

SCHEMBL7490773

Nc1c(Cl)cc(C(=O)N[C@@H]2N=C(c3ccccc3)c3cccc4c3N(CC4)C2=O)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 20/20 1.00
▸ PDE4B Q07343 20/20 1.00
▸ PDE4C Q08493 20/20 1.00
▸ PDE4D Q08499 20/20 1.00
▸ PDE3B Q13370 11/20 0.82
▸ PDE3A Q14432 11/20 0.82
▸ PDE5A O76074 6/20 0.76
▸ PDE1A P54750 6/20 0.76
▸ PDE1B Q01064 6/20 0.76
▸ PDE1C Q14123 6/20 0.76

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
SCHEMBL7490769 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7495324 0.91 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7156582 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7156583 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7494548 0.89 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7501830 0.89 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7494552 0.89 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7819538 0.89 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7497465 0.88 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7821690 0.88 PDE4A (0.89) PDE4APDE4BPDE4CPDE4DPDE3B

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-0785789-B1 DIAZEPINO-INDOLES AS PHOSPHODIESTERASE IV INHIBITORS PFIZER (FR) 2002-09-11 — — EP claimed