SCHEMBL7306170

SCHEMBL7306170

NC(=O)C(CCOc1ccc2c(c1)N=C(N)N(CC(=O)NCc1ccccc1)C2)N1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 16/20 0.42
PDE4B Q07343 16/20 0.42
PDE4C Q08493 16/20 0.42
PDE4D Q08499 16/20 0.42
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7316523 0.89 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7314035 0.87 LMNA (0.35) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7317311 0.87 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL7318898 0.86 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7319536 0.84 PDE4A (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL7306174 0.83 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL7306766 0.81 PDE4A (0.51) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311017 0.77 PDE4A (0.45) PDE4APDE4BPDE4CPDE4D
SCHEMBL7310209 0.76 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7312710 0.76 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4761416-A ENZYME INHIBITORS, INOTROPIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-02 US disclosed
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed
EP-0254327-A2 N-N-disubstituted-omega-(2-amino-3-(carbonylmethyl)-3,4-dihydroquinazolinyl) oxyalkylamides and related compounds SYNTEX (U.S.A.) INC. (US) 1988-01-27 EP disclosed