SCHEMBL11630656

SCHEMBL11630656

CCOC(=O)c1cnc2ccc3ccccc3n2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.60
MEN1 O00255 4/20 0.60
POLB P06746 2/20 0.60
KDM4E B2RXH2 11/20 0.56
GAA P10253 6/20 0.56
GLA P06280 5/20 0.56
ALDH1A1 P00352 7/20 0.52
HPGD P15428 6/20 0.52
MAPT P10636 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HSD17B10 Q99714 4/20 0.46
LMNA P02545 3/20 0.46
MAPK1 P28482 3/20 0.46
TP53 P04637 2/20 0.46
HTT P42858 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
ATM Q13315 1/20 0.45

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
SCHEMBL11625043 0.80 MEN1 (0.56) KMT2AMEN1POLBKDM4EGAA
SCHEMBL10740535 0.80 KDM4E (0.53) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11248747 0.80 KDM4E (0.60) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11623768 0.79 MEN1 (0.55) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11624395 0.79 MEN1 (0.55) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11388659 0.78 MEN1 (0.54) KMT2AMEN1POLBKDM4EGAA
SCHEMBL23295573 0.75 MEN1 (1.00) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11643359 0.74 KDM4E (0.70) KMT2AMEN1POLBKDM4EGAA
SCHEMBL11777403 0.74 SMN1; SMN2 (0.54) POLBKDM4EGAAHPGDMAPT
SCHEMBL10739754 0.74 KDM4E (0.53) KMT2AMEN1POLBKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4066766-A 1-Oxo-6-substituted pyrimido [1,2-a]quinoline-2-carboxylic acids and derivatives thereof and their use as antiallergy agents PFIZER INC. (US) 1978-01-03 US disclosed
US-4031217-A PYRIMIDINE-QUINOLINE COMPOUNDS PFIZER INC. (US) 1977-06-21 US disclosed
US-4017625-A Anti-allergic N-(5-tetrazolyl)-1-oxo-1H-6-alkoxypyrimido-[1,2-a]quinoline-2-carboxamides and intermediates therefor PFIZER INC. (US) 1977-04-12 US disclosed
US-4014881-A ANTIULCER AGENTS PFIZER INC. (US) 1977-03-29 US disclosed