SCHEMBL9429588

SCHEMBL9429588

COc1ccc(CCCCCCCCOc2ccc(SCc3ccc4cccnc4c3)nc2C=CCC(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.52

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
SCHEMBL9429565 0.92 LTB4R (0.62) LTB4R
SCHEMBL9334187 0.87 LTB4R (0.62) LTB4R
SCHEMBL9337180 0.85 LTB4R (0.63) LTB4R
SCHEMBL9545803 0.80 LTB4R (0.52) LTB4R
SCHEMBL9333834 0.80 LTB4R (0.73) LTB4R
SCHEMBL9333807 0.79 LTB4R (0.73) LTB4R
SCHEMBL9541578 0.79 LTB4R (0.51) LTB4R
SCHEMBL8731955 0.78 LTB4R (0.78) LTB4R
SCHEMBL9333870 0.78 LTB4R (0.75) LTB4R
SCHEMBL8862019 0.78 LTB4R (0.55) LTB4R

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994014797-A1 QUINOLINE COMPOUNDS AND THE TREATMENT OF LEUCOTRIENE RELATED DISEASES THEREWITH SMITHKLINE BEECHAM CORPORATION (US) 1994-07-07 WO disclosed