SCHEMBL8997771

SCHEMBL8997771

CCN(CC)C(=O)c1ccc(Cl)c(Cl)c1-c1ccc(OC)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.49
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 2/20 0.42
SLC6A3 Q01959 1/20 0.42
HSP90AA1 P07900 2/20 0.41
CYP1A2 P05177 1/20 0.41
HSP90AB1 P08238 1/20 0.41
BLM P54132 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HCRTR2 O43614 6/20 0.41
HCRTR1 O43613 4/20 0.41
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40

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
SCHEMBL8751479 0.90 HSP90AA1 (0.46) PDE4BKMT2ALMNAHPGDMAPK1
SCHEMBL10013750 0.73 CYP1A2 (0.46) PDE4BMEN1KMT2ALMNAMAPK1
SCHEMBL3558491 0.72 TSHR (0.52) MEN1KMT2ALMNAHPGDKDM4E
SCHEMBL6061977 0.71 PDE4B (0.58) PDE4BMEN1KMT2ALMNAHPGD
SCHEMBL22451089 0.70 PDE4B (0.65) PDE4BMEN1KMT2ALMNAHPGD
SCHEMBL9145484 0.70 PDE4B (0.53) PDE4BMEN1KMT2ALMNAHPGD
SCHEMBL14134428 0.70 HPGD (0.50) PDE4BMEN1KMT2ALMNAHPGD
SCHEMBL13216464 0.70 HSP90AA1 (0.77) MEN1KMT2ALMNAHPGDMAPK1
SCHEMBL9187420 0.69 PDE4B (0.48) PDE4BMEN1KMT2ALMNAHPGD
SCHEMBL22451020 0.69 PDE4B (0.73) PDE4BMEN1KMT2ALMNAHPGD

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
US-5514719-A Fungicidal phenylbenzamides RHONE-POULENC AGROCHIMIE (FR) 1996-05-07 US disclosed