SCHEMBL30117599

SCHEMBL30117599

COc1ccc(CC2(O)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.48
GAA P10253 2/20 0.46
POLB P06746 1/20 0.46
LTA4H P09960 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
NR1H3 Q13133 1/20 0.41
NSD2 O96028 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
CCR6 P51684 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
IDO1 P14902 1/20 0.40

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
SCHEMBL28938035 1.00 PDK2 (0.48) PDK2GAAPOLBLTA4HMEN1
SCHEMBL30117601 1.00 PDK2 (0.48) PDK2GAAPOLBLTA4HMEN1
SCHEMBL30117614 0.89 PDK2 (0.46) PDK2GAAPOLBLTA4HMEN1
SCHEMBL28938039 0.89 PDK2 (0.46) PDK2GAAPOLBLTA4HMEN1
SCHEMBL28340728 0.84 LTA4H (0.50) PDK2GAAPOLBLTA4HMEN1
SCHEMBL7316248 0.80 THRB (0.47) PDK2KMT2AL3MBTL1ALDH1A1LMNA
SCHEMBL28938061 0.78 MAPT (0.41) PDK2GAAMEN1KMT2AL3MBTL1
SCHEMBL12165180 0.75 EHMT2 (0.40) GAALTA4HKDM4EALDH1A1LMNA
SCHEMBL14102874 0.75 MEN1 (0.45) GAAPOLBMEN1KMT2ANR1H3
SCHEMBL28938051 0.75 CYP1A2 (0.44) PDK2

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
CN-115611713-B Synthesis method of 9-benzylated fluorenol derivative 广东工业大学 2024-04-02 CN disclosed
CN-115611713-A Synthesis method of 9-benzylated fluorenol derivative 广东工业大学 2023-01-17 CN disclosed