SCHEMBL9028196

SCHEMBL9028196

C=CCc1c(O)c(CC(=C)C)c(CCC)c(OC(C)=O)c1CCC

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SRD5A1 P18405 1/20 0.33
PTGS1 P23219 1/20 0.32

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
SCHEMBL9028192 0.76 KDM4E (0.37) KDM4EMEN1KMT2ASRD5A1PTGS1
SCHEMBL9027859 0.73 KDM4E (0.35) KDM4EMEN1KMT2ASRD5A1
SCHEMBL9028266 0.71 KDM4E (0.36) KDM4EMEN1KMT2APTGS1
SCHEMBL17612610 0.70 KDM4E (0.43) KDM4EMEN1KMT2ASRD5A1PTGS1
SCHEMBL9027689 0.69 KDM4E (0.36) KDM4EMEN1KMT2ASRD5A1
SCHEMBL9028435 0.69 DHFR (0.37) KDM4EMEN1KMT2A
SCHEMBL9028140 0.69 KDM4E (0.38) KDM4EMEN1KMT2A
SCHEMBL11890175 0.68 PTGS1 (0.44) KDM4EMEN1KMT2ASRD5A1PTGS1
SCHEMBL8603161 0.67 KDM4E (0.42) KDM4EMEN1KMT2ASRD5A1PTGS1
SCHEMBL11890176 0.67 SRD5A1 (0.47) KDM4EMEN1KMT2ASRD5A1PTGS1

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
EP-0445827-B1 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO KK (JP) 1996-09-25 EP disclosed
US-5149834-A Anticholesterol agent and enzyme inhibitors, for curing arteriosclerosis FUJIREBIO INC. (JP) 1992-09-22 US disclosed
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP disclosed