SCHEMBL3624978

SCHEMBL3624978

COCOc1cc(C(=O)O)c(=O)n2cc(Cc3cccc(Cl)c3F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 2/20 0.44
CLCN2 P51788 1/20 0.37
MRGPRX4 Q96LA9 6/20 0.36
KLKB1 P03952 1/20 0.36
CMA1 P23946 5/20 0.35
METTL14 Q9HCE5 1/20 0.34
NOTUM Q6P988 1/20 0.34
RIPK1 Q13546 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
SCHEMBL13316657 0.90 MRGPRX4 (0.39) METTL3MRGPRX4KLKB1CMA1
SCHEMBL3618515 0.86 METTL3 (0.44) METTL3MRGPRX4KLKB1CMA1NOTUM
SCHEMBL3628451 0.84 METTL3 (0.42) METTL3MRGPRX4KLKB1CMA1NOTUM
SCHEMBL3623481 0.82 METTL3 (0.41) METTL3KLKB1CMA1NOTUM
SCHEMBL3624155 0.82 METTL3 (0.42) METTL3MRGPRX4CMA1NOTUM
SCHEMBL3623800 0.81 METTL3 (0.41) METTL3KLKB1CMA1NOTUM
SCHEMBL3625003 0.81 METTL3 (0.41) METTL3CMA1NOTUM
SCHEMBL3625696 0.81 METTL3 (0.44) METTL3CMA1NOTUM
SCHEMBL3624017 0.81 METTL3 (0.43) METTL3KLKB1
SCHEMBL13316686 0.81 METTL3 (0.40) METTL3MRGPRX4CMA1NOTUM

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 3971/4885CLCN2 3567/4885MRGPRX4 4476/4885

“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.