SCHEMBL3624708

SCHEMBL3624708

CC(C)(C)[C@@H](CO)c1cc(C(=O)O)c(=O)n2cc(Cc3cccc(Cl)c3F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.44
CFD P00746 7/20 0.34
CMA1 P23946 4/20 0.33
NOTUM Q6P988 1/20 0.33
PPARG P37231 2/20 0.31
SLC16A3 O15427 1/20 0.31
SLC16A1 P53985 1/20 0.31
MCTS1 Q9ULC4 1/20 0.31
RORC P51449 2/20 0.31
KLKB1 P03952 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
SCHEMBL3620387 0.91 CMA1 (0.40) METTL3CMA1PPARG
SCHEMBL13316620 0.89 METTL3 (0.39) METTL3CMA1
SCHEMBL3624158 0.89 METTL3 (0.47) METTL3CFDCMA1NOTUMPPARG
SCHEMBL3627914 0.88 METTL3 (0.46) METTL3CFDCMA1NOTUMPPARG
SCHEMBL3625696 0.87 METTL3 (0.44) METTL3CFDCMA1NOTUMPPARG
SCHEMBL13349637 0.86 METTL3 (0.36) METTL3CFD
SCHEMBL3623776 0.85 METTL3 (0.57) METTL3CMA1NOTUM
SCHEMBL3623899 0.84 METTL3 (0.49) METTL3CMA1NOTUM
SCHEMBL3627433 0.84 METTL3 (0.40) METTL3CFDCMA1NOTUM
SCHEMBL3620072 0.83 METTL3 (0.39) METTL3CFDCMA1NOTUMSLC16A3

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 3971/4885CFD 4484/4885CMA1 738/4885

“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.