SCHEMBL8556578

SCHEMBL8556578

CCOC(=O)Oc1ccc2ccccc2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MEN1 O00255 1/20 0.52
PRNP P04156 1/20 0.52
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYSLTR2 Q9NS75 2/20 0.44
CYSLTR1 Q9Y271 2/20 0.44
GLA P06280 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 2/20 0.42
CYP1A2 P05177 2/20 0.42
MAPK1 P28482 1/20 0.42
ALOX5 P09917 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL16449635 0.83 KMT2A (0.45) KMT2AMEN1PRNPALDH1A1L3MBTL1
SCHEMBL28029269 0.82 MAPT (0.49) KMT2AMEN1ALDH1A1L3MBTL1KDM4E
SCHEMBL6945665 0.82 MGAM (0.47) KMT2AMEN1PRNPALDH1A1KDM4E
SCHEMBL16449537 0.81 KMT2A (0.48) KMT2AMEN1PRNPALDH1A1L3MBTL1
SCHEMBL8798394 0.80 ALDH1A1 (0.68) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL6601697 0.79 ALDH1A1 (0.70) KMT2AMEN1PRNPALDH1A1L3MBTL1
SCHEMBL4266167 0.78 MAPT (0.49) KMT2AMEN1PRNPALDH1A1L3MBTL1
SCHEMBL28667841 0.78 MEN1 (0.46) KMT2AMEN1PRNPALDH1A1KDM4E
SCHEMBL10709882 0.78 ELANE (0.41) KMT2AMEN1PRNPALDH1A1KDM4E
SCHEMBL11310453 0.78 TSHR (0.56) KMT2AMEN1PRNPALDH1A1L3MBTL1

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
CN-109331862-A A kind of propenal aldehyde acetal/aniline reaction prepares catalyst of quinoline and preparation method thereof 湖南理工学院 2019-02-15 CN disclosed
EP-0529452-B1 1,7-Condensed 3-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them SOLVAY PHARM GMBH (DE) 1998-11-11 EP disclosed
EP-0529452-A2 1,7-Condensed 2-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them Kali-Chemie Pharma GmbH (DE) 1993-03-03 EP disclosed