SCHEMBL3621739

SCHEMBL3621739

O=C(O)c1cc(CCO)c2ncc(Cc3cccc(Cl)c3F)cn2c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.38
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MRGPRX4 Q96LA9 5/20 0.34
BRS3 P32247 2/20 0.34
NOTUM Q6P988 1/20 0.34
PCSK9 Q8NBP7 1/20 0.33
P2RX7 Q99572 1/20 0.33
KMO O15229 1/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 2/20 0.31
ABL1 P00519 1/20 0.31
PDGFRB P09619 1/20 0.31
SRC P12931 1/20 0.31
PDGFRA P16234 1/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL13316636 0.87 PDE3B (0.40) KDM4EALDH1A1KMT2AMRGPRX4TP53
SCHEMBL13349670 0.85 PCSK9 (0.33) METTL3MEN1ALDH1A1KMT2APCSK9
SCHEMBL13316637 0.84 METTL3 (0.33) METTL3KDM4EALDH1A1PCSK9MAPT
SCHEMBL3623959 0.84 METTL3 (0.41) METTL3MRGPRX4NOTUM
SCHEMBL3624155 0.78 METTL3 (0.42) METTL3MRGPRX4NOTUM
SCHEMBL3628451 0.76 METTL3 (0.42) METTL3MRGPRX4NOTUMP2RX7
SCHEMBL3623800 0.76 METTL3 (0.41) METTL3NOTUMP2RX7
SCHEMBL12108141 0.76 METTL3 (0.44) METTL3RXFP1
SCHEMBL3625761 0.75 METTL3 (0.40) METTL3NOTUM
SCHEMBL13316686 0.75 METTL3 (0.40) METTL3MRGPRX4NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745459-B2 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2010-06-29 US claimed
US-20060084665-A1 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2006-04-20 US claimed
US-7745459-B2 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2010-06-29 US disclosed
US-7745459-B2 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2010-06-29 US disclosed
US-7745459-B2 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2010-06-29 US disclosed
US-20060084665-A1 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2006-04-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060084665-A1 Quinolizinone compound and use thereof as HIV integrase inhibitor NQO2, ACE, CDK20 METTL3 3971/4885KDM4E 165/4885MEN1 4589/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.