SCHEMBL28532207

SCHEMBL28532207

CCOC(=O)C(C)=CCCCOc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.55
NPC1 O15118 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
RAB9A P51151 2/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RECQL P46063 1/20 0.46
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
THRB P10828 1/20 0.44
TSHR P16473 2/20 0.44
LMNA P02545 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL27995953 0.89 RECQL (0.49) TDP1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL21340228 0.87 L3MBTL1 (0.49) TDP1NPC1RAB9AMAPTL3MBTL1
SCHEMBL819986 0.84 L3MBTL1 (0.53) TDP1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL27186824 0.83 SMN1; SMN2 (0.45) TDP1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL17534921 0.83 TDP1 (0.44) TDP1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL4094428 0.82 FAAH (0.49) TDP1MEN1KMT2ATSHRLMNA
SCHEMBL2133049 0.81 THRB (0.50) TDP1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL4828682 0.80 KCNA3 (0.52) TDP1SMN1; SMN2GAAL3MBTL1RECQL
Toluene SCHEMBL11879209 0.80 FAAH (0.44) TDP1MAPTGAAMEN1KMT2A
SCHEMBL17556007 0.79 L3MBTL1 (0.50) GAAL3MBTL1RECQLMTNR1AMTNR1B

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-112543891-A Resin composition for protective agent and use thereof 株式会社有泽制作所 2021-03-23 CN disclosed