SCHEMBL16151498

SCHEMBL16151498

C=c1/c(=C\C=C\BOCC2CCCN2)sc2ccc(B(OCC3CCCN3)c3ccsc3)cc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 4/20 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
SCHEMBL12319408 0.88 LTA4H (0.35) LTA4H
SCHEMBL12270361 0.81 LTA4H (0.42) LTA4H
SCHEMBL16151501 0.78 LTA4H (0.33) LTA4H
SCHEMBL12270172 0.68 LTA4H (0.43) LTA4H
SCHEMBL12271149 0.57 KDM4E (0.41) —
SCHEMBL12271070 0.57 LTA4H (0.45) LTA4H
SCHEMBL12266365 0.55 LTA4H (0.48) LTA4H
SCHEMBL13383566 0.55 LTA4H (0.48) LTA4H
SCHEMBL12319283 0.54 LTA4H (0.42) LTA4H
SCHEMBL13383606 0.54 LTA4H (0.52) LTA4H

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-8853424-B2 Protein cross-linking inhibitor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-10-07 — — US disclosed
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