SCHEMBL28118973

SCHEMBL28118973

COc1ccc(C(=O)C(F)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.60
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
POLB P06746 2/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
CES2 O00748 2/20 0.56
CES1 P23141 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
ALDH1A1 P00352 5/20 0.53
LMNA P02545 3/20 0.53
MITF O75030 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HIF1A Q16665 1/20 0.53
CYP1A2 P05177 1/20 0.53
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
ACP3 P15309 1/20 0.50

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
SCHEMBL23086292 0.84 MAPT (0.57) MAPTNPC1RAB9APOLBMEN1
SCHEMBL7560417 0.83 L3MBTL1 (0.66) MAPTNPC1RAB9APOLBMEN1
SCHEMBL5217880 0.83 MAPT (0.63) MAPTNPC1RAB9APOLBMEN1
SCHEMBL29291321 0.83 MAPT (0.56) MAPTNPC1RAB9APOLBMEN1
SCHEMBL4483081 0.82 TDP1 (0.61) CES2CES1NPSR1ALDH1A1LMNA
SCHEMBL4604321 0.81 MAPT (0.61) MAPTNPC1RAB9APOLBMEN1
SCHEMBL29262742 0.81 LMNA (0.67) MAPTNPC1RAB9APOLBMEN1
SCHEMBL812736 0.81 LMNA (0.67) MAPTNPC1RAB9APOLBMEN1
SCHEMBL4604318 0.81 MAPT (0.61) MAPTNPC1RAB9APOLBMEN1
SCHEMBL28398882 0.81 CES2 (0.52) MAPTNPC1RAB9AMEN1KMT2A

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-106348990-B A method of synthesis 1,2,2- triaryl ethyl ketone and its derivative 兰州大学 2019-10-18 CN disclosed
CN-106348990-A Method for synthesizing 1,2,2-triaryl ethyl ketone and derivatives thereof 兰州大学 2017-01-25 CN disclosed