SCHEMBL13316686

SCHEMBL13316686

NCc1cc(C(=O)O)c(=O)n2cc(Cc3cccc(Cl)c3F)ccc12

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.40
CMA1 P23946 7/20 0.37
NOTUM Q6P988 1/20 0.35
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
CFD P00746 2/20 0.34
MRGPRX4 Q96LA9 2/20 0.33
PNMT P11086 1/20 0.33
SLC22A12 Q96S37 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
Hydrochloric Acid SCHEMBL3626742 0.99 METTL3 (0.39) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3628451 0.91 METTL3 (0.42) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3624155 0.91 METTL3 (0.42) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3625171 0.90 METTL3 (0.39) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3625761 0.90 METTL3 (0.40) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3623481 0.89 METTL3 (0.41) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3623959 0.89 METTL3 (0.41) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3621807 0.88 METTL3 (0.38) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3623800 0.88 METTL3 (0.41) METTL3CMA1NOTUMPDE4APDE4B
SCHEMBL3625003 0.88 METTL3 (0.41) METTL3CMA1NOTUMPDE4APDE4B

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 2 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 disclosed
US-7745459-B2 Quinolizinone compound and use thereof as HIV integrase inhibitor JAPAN TOBACCO INC. (JP) 2010-06-29 US disclosed