SCHEMBL9028429

SCHEMBL9028429

C=CCc1cc(O)c(C(C)C)c(CC(=C)C)c1O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
XDH P47989 1/20 0.33
KDM4E B2RXH2 2/20 0.33
AKR1B1 P15121 1/20 0.31
POLB P06746 1/20 0.31
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
DHFR P00374 1/20 0.30

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
SCHEMBL9028130 0.89 KDM4E (0.33) GABRA1GABRB2XDHKDM4EGLA
SCHEMBL9028435 0.77 DHFR (0.37) GABRA1GABRB2KDM4EAKR1B1POLB
SCHEMBL9026750 0.75 GABRA1 (0.39) GABRA1GABRB2XDHKDM4EAKR1B1
SCHEMBL9028182 0.70 GABRA1 (0.33) GABRA1GABRB2KDM4EGLAGAA
SCHEMBL3045553 0.69 GABRA1 (0.47) GABRA1GABRB2XDHKDM4EAKR1B1
SCHEMBL9571652 0.69 MAOB (0.33) KDM4EGLAGAA
SCHEMBL9028140 0.69 KDM4E (0.38) GABRA1GABRB2KDM4EPOLBGLA
SCHEMBL9571334 0.69 MAOB (0.35) KDM4EGLAGAA
SCHEMBL9028520 0.69 GAA (0.33) GABRA1GABRB2KDM4EGLAGAA
SCHEMBL9028192 0.69 KDM4E (0.37) KDM4EAKR1B1MEN1KMT2A

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