SCHEMBL8843005

SCHEMBL8843005

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(CI)O2

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
PDE4A P27815 1/20 0.62
PDE3A Q14432 1/20 0.62
TTPA P49638 3/20 0.53
ALOX5 P09917 3/20 0.53
GSTO1 P78417 2/20 0.47
PTPN1 P18031 1/20 0.47
PSEN1 P49768 9/20 0.44

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
SCHEMBL14168733 0.88 MEN1 (0.64) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL8376060 0.88 MEN1 (0.64) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL9656784 0.87 MEN1 (0.62) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL10724913 0.87 MEN1 (0.62) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL10724905 0.87 MEN1 (0.62) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL11706067 0.86 MEN1 (0.61) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL11705132 0.86 MEN1 (0.61) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL11706578 0.86 MEN1 (0.61) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL8377650 0.86 MEN1 (0.67) MEN1KMT2APDE4APDE3ATTPA
SCHEMBL8601254 0.85 MEN1 (0.66) MEN1KMT2APDE4APDE3ATTPA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663389-A 3,4-Dihydro-2-iodomethyl-2,5,7,8-tetramethyl-2H-1-benzopyrans ALFA WASSERMANN S.P.A. (IT) 1997-09-02 US claimed
EP-0737681-A1 3,4-Dihydro-2-iodomethyl-2,5,7,8-tetramethyl-2H-1-benzopyrans ALFA WASSERMANN S.p.A. (IT) 1996-10-16 EP claimed
EP-0737681-A1 3,4-Dihydro-2-iodomethyl-2,5,7,8-tetramethyl-2H-1-benzopyrans ALFA WASSERMANN S.p.A. (IT) 1996-10-16 EP disclosed