SCHEMBL28120983

SCHEMBL28120983

CC(O)Oc1ccccc1C(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
CYP2C9 P11712 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
ADRA2C P18825 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
ADRA2A P08913 1/20 0.38
HIF1A Q16665 1/20 0.38
ALDH1A1 P00352 4/20 0.37
CHRM2 P08172 1/20 0.36
ADRA1A P35348 1/20 0.36
RGS12 O14924 1/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL11344332 0.80 GABRA1 (0.37) KMT2AADRA2CLMNAADRA2AHIF1A
SCHEMBL4293432 0.80 GABRA1 (0.46) KMT2ACYP2C9MEN1ADRA2CLMNA
SCHEMBL3039320 0.78 IDO1 (0.58) KMT2AMEN1MAPTIDO1TDO2
SCHEMBL34024 0.78 TSHR (0.41) KMT2AMEN1IDO1TDO2KDM4E
SCHEMBL11012886 0.77 KMT2A (0.47) KMT2AMEN1KDM4ELMNAALDH1A1
SCHEMBL2962387 0.77 KMT2A (0.47) KMT2AMEN1KDM4ELMNAALDH1A1
SCHEMBL7115660 0.77 L3MBTL1 (0.40) KMT2AMEN1LMNAALDH1A1GLA
SCHEMBL21420998 0.76 IDO1 (0.41) KMT2AIDO1TDO2ALDH1A1TSHR
SCHEMBL3261670 0.74 IDO1 (0.58) KMT2AMEN1MAPTIDO1TDO2
SCHEMBL9310352 0.73 L3MBTL1 (0.50) MAPTIDO1TDO2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458817-A Novel bis (hydroxyalkoxyphenyl) diphenylmethanes 本州化学工业株式会社 2017-02-22 CN disclosed