SCHEMBL3618400

SCHEMBL3618400

COc1cc2c([C@H](CO)C(C)C)cc(C(=O)O)c(=O)n2cc1Cc1cccc(Cl)c1F

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.60
CMA1 P23946 7/20 0.38
PLA2G4A P47712 5/20 0.37
LMNA P02545 1/20 0.33
EGFR P00533 3/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
LTB4R Q15722 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
NOTUM Q6P988 1/20 0.32

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
SCHEMBL3626780 0.90 METTL3 (0.51) METTL3CMA1PLA2G4ALMNAHTR1D
SCHEMBL3623776 0.89 METTL3 (0.57) METTL3CMA1PLA2G4ALMNAEGFR
SCHEMBL3624158 0.84 METTL3 (0.47) METTL3CMA1NOTUM
SCHEMBL3620362 0.81 METTL3 (0.45) METTL3CMA1PLA2G4ALMNAHTR1D
SCHEMBL3626924 0.76 CMA1 (0.42) METTL3CMA1
SCHEMBL3627914 0.76 METTL3 (0.46) METTL3CMA1NOTUM
SCHEMBL3623899 0.75 METTL3 (0.49) METTL3CMA1PLA2G4ALMNAEGFR
SCHEMBL1044577 0.75 METTL3 (0.86) METTL3CMA1PLA2G4AEGFRLTB4R
SCHEMBL1044579 0.75 METTL3 (0.86) METTL3CMA1PLA2G4AEGFRLTB4R
Elvitegravir SCHEMBL726252 0.75 METTL3 (1.00) METTL3CMA1PLA2G4AEGFRLTB4R

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 3971/4885CMA1 738/4885PLA2G4A 3912/4885

“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.