SCHEMBL3243376

SCHEMBL3243376

CCC[C@@H](CO)n1cc(OC(=O)O)c(=O)c2cc(Cc3cccc(Cl)c3F)c(OC(C)C)cc21

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.56
DHODH Q02127 1/20 0.31
CFD P00746 1/20 0.30

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
SCHEMBL3246670 0.94 METTL3 (0.58) METTL3CFD
SCHEMBL3239732 0.92 METTL3 (0.64) METTL3
SCHEMBL3237593 0.92 METTL3 (0.57) METTL3CFD
SCHEMBL1046151 0.92 METTL3 (0.68) METTL3DHODHCFD
SCHEMBL3245271 0.92 METTL3 (0.55) METTL3
SCHEMBL1046152 0.92 METTL3 (0.68) METTL3DHODHCFD
SCHEMBL3246570 0.88 METTL3 (0.72) METTL3DHODHCFD
SCHEMBL3246638 0.88 METTL3 (0.62) METTL3CFD
SCHEMBL3240115 0.87 METTL3 (0.59) METTL3CFD
SCHEMBL5936819 0.86 METTL3 (0.65) METTL3DHODHCFD

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
EP-1564210-B9 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2010-03-31 EP claimed
EP-1564210-B1 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2009-09-16 EP claimed