Protocatechualdehyde

Protocatechualdehyde

SCHEMBL23610641

C=C(C)C(=O)NCCc1ccc(O)c(O)c1.O=Cc1ccc(O)c(O)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
KDM4E B2RXH2 5/20 0.59
HSD17B10 Q99714 5/20 0.59
HIF1A Q16665 4/20 0.59
HPGD P15428 4/20 0.59
BLM P54132 4/20 0.59
ALDH1A1 P00352 3/20 0.59
LMNA P02545 3/20 0.59
PTGS1 P23219 1/20 0.59
APP P05067 1/20 0.57
ACHE P22303 2/20 0.52
BCHE P06276 1/20 0.52
EGFR P00533 2/20 0.49
TYR P14679 1/20 0.49
PTGS2 P35354 2/20 0.49
RAB9A P51151 2/20 0.49
TP53 P04637 3/20 0.47
CYP1A2 P05177 3/20 0.47
ALOX15 P16050 3/20 0.47
NFKB1 P19838 3/20 0.47

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
SCHEMBL400288 0.89 MAPT (0.73) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL30446328 0.89 MAPT (0.73) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL109163 0.79 MAPT (0.74) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL9962893 0.78 MAPT (0.56) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL28503785 0.77 MAPT (0.59) MAPTKDM4EHSD17B10HIF1AHPGD
Formic Acid SCHEMBL28839111 0.76 MAPT (0.88) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL17266372 0.76 MAPT (0.66) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL339753 0.76 ERCC1 (0.59) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL12305065 0.76 MAPT (0.70) MAPTKDM4EHSD17B10HIF1AHPGD
SCHEMBL30616852 0.76 MAPT (1.00) MAPTKDM4EHSD17B10HIF1AHPGD

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-20210207317-A1 SURFACE MODIFIED MICROCAPSULES INTERNATIONAL FLAVORS & FRAGRANCES INC. 2021-07-08 US disclosed