SCHEMBL3625003

SCHEMBL3625003

CN(C)Cc1cc(C(=O)O)c(=O)n2cc(Cc3cccc(Cl)c3F)ccc12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.41
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 3/20 0.39
SLC6A3 Q01959 3/20 0.39
CFD P00746 8/20 0.36
NOTUM Q6P988 1/20 0.36
CMA1 P23946 2/20 0.36
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33

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
SCHEMBL3628451 0.91 METTL3 (0.42) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL3623481 0.89 METTL3 (0.41) METTL3SLC6A2SLC6A4SLC6A3CFD
SCHEMBL3624155 0.89 METTL3 (0.42) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL3623800 0.88 METTL3 (0.41) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL3625761 0.88 METTL3 (0.40) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL13316686 0.88 METTL3 (0.40) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL3619765 0.88 METTL3 (0.38) METTL3SLC6A4CFDNOTUMCMA1
SCHEMBL3618515 0.87 METTL3 (0.44) METTL3CFDNOTUMCMA1
Hydrochloric Acid SCHEMBL3626742 0.87 METTL3 (0.39) METTL3CFDNOTUMCMA1PDE4A
SCHEMBL3623959 0.87 METTL3 (0.41) METTL3CFDNOTUMCMA1PDE4A

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 3971/4885SLC6A2 1356/4885SLC6A4 1440/4885

“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.