SCHEMBL17802256

SCHEMBL17802256

CN(C)Cc1cnc2c(OCc3ccccc3)cccn2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 6/20 0.48
PSEN2 P49810 6/20 0.48
APH1B Q8WW43 6/20 0.48
NCSTN Q92542 6/20 0.48
APH1A Q96BI3 6/20 0.48
PSENEN Q9NZ42 6/20 0.48
ATP4A P20648 3/20 0.48
ATP4B P51164 3/20 0.48
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAPK1 P28482 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
MAPK14 Q16539 4/20 0.41
MAPK8 P45983 3/20 0.41

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
Hydrochloric Acid SCHEMBL19348519 0.99 PSEN1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28460918 0.84 ATP4A (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9748655 0.83 ATP4A (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17802280 0.82 ATP4A (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
Iodomethane SCHEMBL11069979 0.81 ATP4A (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10379243 0.77 PSEN1 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17808887 0.76 CHEK1 (0.40) MEN1KMT2AMAPK14MAPK8MAPK9
Hydrochloric Acid SCHEMBL17802250 0.74 CHEK1 (0.39) MEN1KMT2AMAPK14MAPK8MAPK9
SCHEMBL17802254 0.74 KDM4E (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11062878 0.74 ATP4A (0.74) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3227292-B1 4H-PYRIDO[1,2-a]PYRIMIDIN-4-ONE COMPOUNDS ALTERITY THERAPEUTICS LTD (AU) 2022-03-09 EP disclosed
CN-111961050-A 4H-pyrido [1,2-a ] pyrimidin-4-one compounds 普拉纳生物技术有限公司 2020-11-20 CN disclosed
CN-107001360-B 4H-pyrido [1,2-a ] pyrimidin-4-one compounds 普拉纳生物技术有限公司 2020-09-18 CN disclosed
EP-3227292-A1 4H-PYRIDO[1,2-a]PYRIMIDIN-4-ONE COMPOUNDS Prana Biotechnology Ltd (AU) 2017-10-11 EP disclosed
WO-2016086261-A1 4H-PYRIDO[1,2-a]PYRIMIDIN-4-ONE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2016-06-09 WO disclosed