SCHEMBL9313665

SCHEMBL9313665

CCOCCOc1c(C)c(C)c2c(c1C)CCC(C)(CCNc1cc(C)cc(C)n1)O2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.38
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PDE4A P27815 1/20 0.34
PDE3A Q14432 1/20 0.34
GSTO1 P78417 2/20 0.33
PTPN1 P18031 1/20 0.32
CYP4F2 P78329 1/20 0.32
MAPT P10636 2/20 0.31
AKT1 P31749 1/20 0.31
LMNA P02545 1/20 0.31
GSTP1 P09211 1/20 0.31
TTPA P49638 1/20 0.31

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
SCHEMBL9314118 0.92 PSEN1 (0.39) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9314864 0.87 PSEN1 (0.37) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9313669 0.86 PSEN1 (0.43) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9314082 0.85 MEN1 (0.42) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9313801 0.85 PSEN1 (0.54) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9314041 0.84 PSEN1 (0.42) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL9655989 0.82 MAPT (0.47) MEN1KMT2ACYP4F2MAPTLMNA
SCHEMBL9655104 0.80 PSEN1 (0.49) PSEN1TTPA
SCHEMBL9258125 0.80 PSEN1 (0.45) PSEN1LMNATTPA
SCHEMBL9656054 0.77 PSEN1 (0.35) PSEN1MEN1KMT2APDE4APDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5315017-A Peroxidation and eicosanoid biosynthesis inhibition ADIR ET COMPAGNIE (FR) 1994-05-24 US disclosed
EP-0512899-A1 Benzopyran compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-11-11 EP disclosed