SCHEMBL8852823

SCHEMBL8852823

CC(Cc1ccccc1Oc1ccc(Cl)cc1)CN1CC(C)OC(C)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SIGMAR1 Q99720 3/20 0.45
EBP Q15125 1/20 0.45
HTR2A P28223 3/20 0.44
SLC6A4 P31645 3/20 0.44
KDM4E B2RXH2 3/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
PPARA Q07869 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD3 P35462 1/20 0.42

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
SCHEMBL9242248 0.86 KDM4E (0.52) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL8852831 0.82 SIGMAR1 (0.62) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL9242250 0.79 KDM4E (0.49) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL9141946 0.77 SIGMAR1 (0.71) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL9862826 0.76 ADORA3 (0.46) MAPK1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9355019 0.73 EBP (0.66) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL2133766 0.72 SIGMAR1 (0.61) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL2133759 0.72 SIGMAR1 (0.61) MAPK1ALDH1A1SMN1; SMN2MEN1THRB
SCHEMBL10500566 0.72 EBP (0.51) MAPK1ALDH1A1SMN1; SMN2SIGMAR1EBP
SCHEMBL10576529 0.72 EBP (0.51) MAPK1ALDH1A1SMN1; SMN2SIGMAR1EBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467792-B1 Fungicidal composition for the treatment of seeds RHONE POULENC AGROCHIMIE (FR) 1995-05-10 EP claimed
EP-0467792-A1 Fungicidal composition for the treatment of seeds RHONE-POULENC AGROCHIMIE (FR) 1992-01-22 EP claimed
US-5629330-A USED WITH CEREALS, MIXTURE OF FUNGICIDES RHONE POULENC SECTEUR AGROCHIMIE (FR) 1997-05-13 US disclosed
EP-0467792-B1 Fungicidal composition for the treatment of seeds RHONE POULENC AGROCHIMIE (FR) 1995-05-10 EP disclosed
US-5290791-A Fungicidal composition for seed dressing RHONE-POULENC SECTEUR AGROCHIMIE (FR) 1994-03-01 US disclosed
EP-0467792-A1 Fungicidal composition for the treatment of seeds RHONE-POULENC AGROCHIMIE (FR) 1992-01-22 EP disclosed
EP-0433194-A1 Fungicide composition with synergistic effect based on one morpholine and one triazole RHONE-POULENC AGROCHIMIE (FR) 1991-06-19 EP disclosed