SCHEMBL18378653

SCHEMBL18378653

C=C(/C=C\C)C(=O)N[C@H](CC(=O)OC)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ALOX5 P09917 1/20 0.32
PNLIP P16233 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
SCHEMBL18377771 1.00 CA12 (0.35) CA12CA1CA2CA9ALOX5
SCHEMBL8269509 0.81 NOS2 (0.39) CA12CA1CA2CA9PNLIP
SCHEMBL8955981 0.79 TGFBR1 (0.49) CA12CA1CA2CA9ALOX5
SCHEMBL18377626 0.79 CA12 (0.35) CA12CA1CA2CA9ALOX5
SCHEMBL24670989 0.73 TSHR (0.41) CA12CA1CA2CA9
SCHEMBL16539978 0.72 TSHR (0.44) CA12CA1CA2CA9
SCHEMBL16539979 0.72 TSHR (0.44) CA12CA1CA2CA9
SCHEMBL468839 0.71 CA12 (0.42) CA12CA1CA2CA9ALOX5
SCHEMBL38274 0.71 CA12 (0.42) CA12CA1CA2CA9ALOX5
SCHEMBL15148548 0.71 CA12 (0.42) CA12CA1CA2CA9ALOX5

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-2017006295-A1 HYDROXY FORMAMIDE DERIVATIVES AND THEIR USE GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-01-12 WO disclosed