SCHEMBL29345014

SCHEMBL29345014

CC(C)C(=O)C=Cc1ccc(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.66
PTGS1 P23219 1/20 0.66
TTR P02766 3/20 0.62
KDM4E B2RXH2 2/20 0.62
HSD17B10 Q99714 2/20 0.62
APP P05067 2/20 0.62
MAPT P10636 2/20 0.62
PTPN1 P18031 2/20 0.62
DPP4 P27487 2/20 0.62
MEN1 O00255 1/20 0.62
HDAC3 O15379 1/20 0.62
CA12 O43570 1/20 0.62
AKR1B10 O60218 1/20 0.62
ALDH1A1 P00352 1/20 0.62
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
LMNA P02545 1/20 0.62
MMP1 P03956 1/20 0.62
GLA P06280 1/20 0.62
POLB P06746 1/20 0.62

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
SCHEMBL15981545 1.00 IAPP (0.66) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL8365088 0.88 IAPP (0.64) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL12377737 0.86 IAPP (0.49) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL12088589 0.82 MMP9 (0.72) PTGS1KDM4EHSD17B10APPMAPT
SCHEMBL31643299 0.81 IAPP (0.55) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL7752807 0.80 IAPP (0.58) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL1881134 0.79 IAPP (1.00) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL1881133 0.79 IAPP (1.00) IAPPPTGS1TTRKDM4EHSD17B10
SCHEMBL13191552 0.79 MMP2 (0.62) MAPTDPP4MEN1HDAC3CA12
SCHEMBL29364807 0.79 IAPP (1.00) IAPPPTGS1TTRKDM4EHSD17B10

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-2024151693-A1 A VIBRANT AND STABLE BLUE COLORANT AND METHODS OF MAKING AND USE THEREOF OHIO STATE INNOVATION FOUNDATION (US) 2024-07-18 WO disclosed