SCHEMBL8433831

SCHEMBL8433831

COc1ccc(CCCCOC=C(C(=O)O)c2cccc(CSc3ccccc3OC)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 19/20 0.48
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8434457 0.92 LTB4R (0.46) LTB4R
SCHEMBL8430422 0.91 LTB4R (0.51) LTB4R
SCHEMBL8431807 0.91 LTB4R (0.46) LTB4R
SCHEMBL8430691 0.91 LTB4R (0.51) LTB4R
SCHEMBL8916838 0.90 LTB4R (0.57) LTB4R
SCHEMBL8434525 0.86 LTB4R (0.50) LTB4R
SCHEMBL8434511 0.86 LTB4R (0.49) LTB4R
SCHEMBL8430615 0.85 LTB4R (0.60) LTB4R
SCHEMBL8430574 0.85 LTB4R (0.47) LTB4R
SCHEMBL8433623 0.85 LTB4R (0.59) 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
US-5929096-A TREATING DISEASES ATTRIBUTING THEIR ORIGIN OR AFFECT TO LEUKOTRIENES, ANTIALLERGENS SMITHKLINE BEECHAM CORPORATION (US) 1999-07-27 US disclosed