SCHEMBL9313627

SCHEMBL9313627

CCOC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(CC(=O)Nc1cc(C)cc(C)n1)O2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE4A P27815 1/20 0.39
PDE3A Q14432 1/20 0.39
MAPK1 P28482 1/20 0.37
PTPN1 P18031 1/20 0.36
GSTO1 P78417 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
PSEN1 P49768 5/20 0.36
TTPA P49638 2/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL9655667 0.91 KMT2A (0.48) MEN1KMT2APDE4APDE3AMAPK1
SCHEMBL9313487 0.89 PSEN1 (0.40) MEN1KMT2APDE4APDE3AMAPK1
SCHEMBL9314041 0.87 PSEN1 (0.42) MEN1KMT2APDE4APDE3AMAPK1
SCHEMBL9314952 0.86 PSEN1 (0.38) MEN1KMT2APDE4APDE3AMAPK1
SCHEMBL9314082 0.86 MEN1 (0.42) MEN1KMT2APDE4APDE3APTPN1
SCHEMBL9655147 0.86 PSEN1 (0.49) MEN1KMT2APDE4APDE3AMAPK1
SCHEMBL9313495 0.85 TTPA (0.44) CHRNB2CHRNB4CHRNA3CHRNA4LMNA
SCHEMBL9655394 0.85 CYP3A4 (0.44) MEN1KMT2AMAPK1LMNACYP1A2
SCHEMBL9254414 0.84 PSEN1 (0.41) MEN1KMT2APDE4APDE3ACHRNB2
SCHEMBL9428314 0.78 MEN1 (0.49) MEN1KMT2APDE4APDE3APTPN1

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