SCHEMBL8267262

SCHEMBL8267262

CC(Cc1ccc(O)cc1)NC(=O)COc1ccc(C2=NNC(=O)CC2)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
PDE4B Q07343 2/20 0.43
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 1/20 0.42
ADRB3 P13945 6/20 0.40
ALDH1A1 P00352 1/20 0.38
NPY1R P25929 1/20 0.37
NPY2R P49146 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
PKM P14618 1/20 0.36
MME P08473 1/20 0.36

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
SCHEMBL7328506 0.86 LMNA (0.47) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL4887950 0.84 HPGD (0.49) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL4884827 0.83 LMNA (0.46) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL4881326 0.82 PDE3B (0.42) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL10867608 0.81 PDE4B (0.48) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL7326426 0.79 PDE3B (0.47) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL10474304 0.79 PDE3B (0.50) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL9657454 0.78 PDE3B (0.45) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL4573757 0.77 PDE3B (0.54) LMNAPDE4BPDE4APDE4CPDE4D
SCHEMBL10515930 0.76 MEN1 (0.49) LMNAPDE4BPDE4APDE4CPDE4D

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
WO-2006060127-A2 COMPOUNDS WITH MIXED PDE-INHIBITORY AND β-ADRENERGIC ANTAGONIST OR PARTIAL AGONIST ACTIVITY FOR TREATMENT OF HEART FAILURE ARTESIAN THERAPEUTICS, INC. (US) 2006-06-08 WO disclosed